0 B12R1.256 C=C(C)c1ccc(cc1)B(O)O 271570a_100000694244_100000754493 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.256 C=C(C)c1ccc(cc1)C(=C)C 271570a_100000694244_100000185454 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 1458a_200009908186_200000210301 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 271570a_100000694244_100000185465 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.256 C=C(C)c1ccc(cc1)C(=O)N 271570a_100000694244_100000162191 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.256 C=C(C)c1ccc(cc1)C(=O)[13CH3] 1458a_200009908186_200025704644 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.256 C=C(C)c1ccc(cc1)C(C)C 271570a_100000694244_100000750031 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.256 C=C(C)c1ccc(cc1)C(C)O 271570a_100000694244_100000745893 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.256 C=C(C)c1ccc(cc1)N(C)C 271570a_100000694244_100000210421 [0,0,0,0,0,0|2,0,0]=2 9 B12R1.256 C=C(C)c1ccc(cc1)S(=O)C 271570a_100000694244_100009816266 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.256 C=C(C)c1ccc(cc1)[C@@H](C)N 271570a_100000694244_100000720352 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.256 C=C(C)c1ccc(cc1)[C@H](C)N 271570a_100000694244_100000753911 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.256 C=C(C)c1ccc(cn1)C(=O)C 271570a_100000694244_100000684857 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.256 C=C(C)c1ccc(cn1)C(=O)N 271570a_100000694244_100000162237 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.256 C=C(C)c1ccc(cn1)C(C)C 271570a_100000694244_200009815286 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.256 C=C(C)c1ccc(cn1)N(C)C 271570a_100000694244_100009992925 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.256 C=C(C)c1ccc(nc1)C(=O)C 271570a_100000694244_100000686046 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.256 C=C(C)c1ccc(nc1)C(=O)N 271570a_100000694244_100011219284 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.256 C=C(C)c1ccc(nc1)C(C)C 271570a_100000694244_100010255768 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.256 C=C(C)c1ccc(nc1)N(C)C 271570a_100000694244_100011465347 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.256 C=C(C)c1ccc(nn1)N(C)C 271570a_100000694244_100000215273 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.256 C=C(C)c1cnc(cn1)N(C)C 271570a_100000694244_100012356732 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.256 C=C(C)c1cnc(nc1)N(C)C 271570a_100000694244_100011934759 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.256 CC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200000210301 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.256 CC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_200000210301 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.256 CC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_200000210301 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.256 CC(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200000210301 [0,0,0,0,0,0|4,0,0]=4 27 B12R1.256 CC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_200000210301 [0,0,0,0,0,0|1,0,0]=1 28 B12R1.256 CC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_200000210301 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.256 CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200000210301 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.256 CC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000690552 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.256 CC(=O)c1cnc(cn1)N(C)C 27a_100102631434_100009883172 [0,0,0,0,0,0|3,0,0]=3 32 B12R1.256 CC(=O)c1cnc(nc1)N(C)C 27a_100102631434_100000099681 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.256 CC(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210772_200025704644 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.256 CC(C)c1ccc(cc1)N(C)C 2230a_100000688768_200000210301 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.256 CC(C)c1ccc(cc1)N(C)C 269982a_100000688768_200000210301 [0,0,0,0,0,0|2,0,1]=3 36 B12R1.256 CC(C)c1ccc(cc1)N(C)C 34a_100000688768_200000210301 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.256 CC(C)c1ccc(cc1)N(C)C 38a_100000688768_200000210301 [0,0,0,0,0,0|2,0,1]=3 38 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 2230a_100000688768_200025704644 [0,0,0,0,0,0|2,0,1]=3 39 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 269982a_100000688768_200025704644 [0,0,0,0,0,0|2,0,1]=3 40 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 34a_100000688768_200025704644 [0,0,0,0,0,0|2,0,1]=3 41 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 38a_100000688768_200025704644 [0,0,0,0,0,0|2,0,1]=3 42 B12R1.256 CC(O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000076921_200025704644 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.256 CN(C)c1ccc(cc1)C(=O)N 27a_100102631434_100000162191 [0,0,0,0,0,0|1,0,0]=1 44 B12R1.256 CN(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210873_200025704644 [0,0,0,0,0,0|1,0,0]=1 45 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200000210301 [0,0,0,0,0,0|1,0,1]=2 46 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200000210301 [0,0,0,0,0,0|1,0,1]=2 47 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200000210301 [0,0,0,0,0,0|1,0,1]=2 48 B12R1.256 CN(C)c1ccc(cn1)C(=O)N 27a_100102631434_100000162237 [0,0,0,0,0,0|2,0,0]=2 49 B12R1.256 CN(C)c1ccc(nn1)C(=O)N 27a_100102631434_100000761398 [0,0,0,0,0,0|3,0,0]=3 50 B12R1.256 CN(C)c1cnc(cn1)C(=O)N 27a_100102631434_100000738300 [0,0,0,0,0,0|3,0,0]=3 51 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200025704644 [0,0,0,0,0,0|1,0,1]=2 52 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200025704644 [0,0,0,0,0,0|1,0,1]=2 53 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200025704644 [0,0,0,0,0,0|1,0,1]=2 54 B12R1.256 CS(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_200000217594_200025704644 [0,0,0,0,0,0|3,0,0]=3 55 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200025704644 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B12R1.256 [13CH3]C(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200025704644 [0,0,0,0,0,0|3,0,1]=4 58 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [1,0,0,0,0,0|1,0,1]=3 61 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [1,0,0,0,0,0|1,0,2]=4 63 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [1,0,0,0,0,0|3,0,0]=4 73 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.3 C=C(C)c1ccc(cn1)C=O 271570a_100000694244_100000766901 [1,0,0,0,0,0|2,0,1]=4 76 B11R1.3 C=C(C)c1ccc(cn1)NC 271570a_100000694244_100000764248 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.3 C=C(C)c1ccc(nc1)C=O 271570a_100000694244_100000754260 [1,0,0,0,0,0|2,0,1]=4 78 B11R1.3 C=C(C)c1ccc(nc1)NC 271570a_100000694244_100000741341 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [1,0,0,0,0,0|2,0,1]=4 80 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [1,0,0,0,0,0|2,0,1]=4 81 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.3 C=Cc1ccc(cc1)C(=O)N 271570a_100011290941_100000162191 [1,0,0,0,0,0|2,0,1]=4 83 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [1,0,0,0,0,0|2,0,1]=4 84 B11R1.3 C=Cc1ccc(cc1)C(C)C 271570a_100011290941_100000750031 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.3 C=Cc1ccc(cc1)C(C)O 271570a_100011290941_100000745893 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.3 C=Cc1ccc(cc1)N(C)C 271570a_100011290941_100000210421 [1,0,0,0,0,0|1,0,0]=2 87 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.3 C=Cc1ccc(cc1)[C@@H](C)N 271570a_100011290941_100000720352 [1,0,0,0,0,0|3,0,0]=4 89 B11R1.3 C=Cc1ccc(cc1)[C@H](C)N 271570a_100011290941_100000753911 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.3 C=Cc1ccc(cn1)C(C)C 271570a_100011290941_200009815286 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.3 C=Cc1ccc(cn1)N(C)C 271570a_100011290941_100009992925 [1,0,0,0,0,0|2,0,0]=3 92 B11R1.3 C=Cc1ccc(nc1)C(C)C 271570a_100011290941_100010255768 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.3 C=Cc1ccc(nc1)N(C)C 271570a_100011290941_100011465347 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.3 C=Cc1ccc(nn1)N(C)C 271570a_100011290941_100000215273 [1,0,0,0,0,0|3,0,0]=4 95 B11R1.3 C=Cc1cnc(cn1)N(C)C 271570a_100011290941_100012356732 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.3 C=Cc1cnc(nc1)N(C)C 271570a_100011290941_100011934759 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.3 C=Cc1cnc(nc1)N(C)C 27a_100102631434_200000143982 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [1,0,0,0,0,0|2,0,1]=4 100 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [1,0,0,0,0,0|2,0,0]=3 101 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [1,0,0,0,0,0|2,0,0]=3 102 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [1,0,0,0,0,0|2,0,0]=3 103 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [1,0,0,0,0,0|2,0,0]=3 104 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [1,0,0,0,0,0|3,0,0]=4 110 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 2230a_100000210773_200025704644 [1,0,0,0,0,0|2,0,1]=4 111 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 34a_100000210773_200025704644 [1,0,0,0,0,0|2,0,1]=4 112 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 7a_100000210773_200025704644 [1,0,0,0,0,0|2,0,1]=4 113 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [1,0,0,0,0,0|3,0,0]=4 115 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_100000750031_200025704644 [1,0,0,0,0,0|3,0,0]=4 116 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000750031 [1,0,0,0,0,0|3,0,0]=4 117 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 2230a_100011216399_200025704644 [1,0,0,0,0,0|1,0,1]=3 118 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 34a_100011216399_200025704644 [1,0,0,0,0,0|1,0,1]=3 119 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [1,0,0,0,0,0|2,0,1]=4 120 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [1,0,0,0,0,0|2,0,1]=4 121 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_100000745893_200025704644 [1,0,0,0,0,0|2,0,1]=4 122 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000745893 [1,0,0,0,0,0|2,0,1]=4 123 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [1,0,0,0,0,0|2,0,0]=3 124 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [1,0,0,0,0,0|2,0,0]=3 125 B11R1.3 CN(C)c1ccc(cc1)C#N 269982a_100000739737_200000210301 [1,0,0,0,0,0|1,0,1]=3 126 B11R1.3 CN(C)c1ccc(cc1)C#N 34a_100000739737_200000210301 [1,0,0,0,0,0|1,0,1]=3 127 B11R1.3 CN(C)c1ccc(cc1)N[13CH3] 34a_100016997997_200025704644 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [1,0,0,0,0,0|2,0,0]=3 129 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_100000210421_200025704644 [1,0,0,0,0,0|2,0,0]=3 130 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000210421 [1,0,0,0,0,0|2,0,0]=3 131 B11R1.3 CN(C)c1ccc(cn1)C#N 27a_100102631434_100000241038 [1,0,0,0,0,0|2,0,1]=4 132 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_100011465347_200025704644 [1,0,0,0,0,0|3,0,0]=4 133 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_200025704644_100011465347 [1,0,0,0,0,0|3,0,0]=4 134 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_100009992925_200025704644 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_200025704644_100009992925 [1,0,0,0,0,0|3,0,0]=4 136 B11R1.3 CN(C)c1cnc(cn1)C=O 27a_100102631434_100012001714 [1,0,0,0,0,0|2,0,0]=3 137 B11R1.3 CN(C)c1cnc(cn1)CO 27a_100102631434_100012002382 [1,0,0,0,0,0|2,0,1]=4 138 B11R1.3 CN(C)c1ncc(cn1)C=O 27a_100102631434_100000070856 [1,0,0,0,0,0|2,0,0]=3 139 B11R1.3 CN(C)c1ncc(cn1)CO 27a_100102631434_100009855073 [1,0,0,0,0,0|2,0,1]=4 140 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 269982a_100000739737_200025704644 [1,0,0,0,0,0|1,0,1]=3 141 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 34a_100000739737_200025704644 [1,0,0,0,0,0|1,0,1]=3 142 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [1,0,0,0,0,0|1,0,0]=2 143 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [1,0,0,0,0,0|1,0,0]=2 144 B11R1.3 CNc1ccc(cc1)C(C)C 2230a_100000210773_200000210301 [1,0,0,0,0,0|2,0,1]=4 145 B11R1.3 CNc1ccc(cc1)C(C)C 34a_100000210773_200000210301 [1,0,0,0,0,0|2,0,1]=4 146 B11R1.3 CNc1ccc(cc1)C(C)C 7a_100000210773_200000210301 [1,0,0,0,0,0|2,0,1]=4 147 B11R1.3 CNc1ccc(cc1)C(C)O 2230a_100011216399_200000210301 [1,0,0,0,0,0|1,0,1]=3 148 B11R1.3 CNc1ccc(cc1)C(C)O 34a_100011216399_200000210301 [1,0,0,0,0,0|1,0,1]=3 149 B11R1.3 CNc1ccc(cc1)C(F)F 34a_100020620101_200000210301 [1,0,0,0,0,0|2,0,1]=4 150 B11R1.3 CNc1ccc(cc1)C(F)F 7a_100020620101_200000210301 [1,0,0,0,0,0|2,0,1]=4 151 B11R1.3 CNc1ccc(cc1)N(C)C 34a_100016997997_200000210301 [1,0,0,0,0,0|2,0,0]=3 152 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200000210301 [1,0,0,0,0,0|1,0,1]=3 153 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200000210301 [1,0,0,0,0,0|1,0,1]=3 154 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [1,0,0,0,0,0|2,0,0]=3 155 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.3 CNc1ccc(nn1)C(=O)N 27a_100102657272_100000761398 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.3 CNc1cnc(cn1)C(=O)C 27a_100102657272_100009883172 [1,0,0,0,0,0|3,0,0]=4 158 B11R1.3 CNc1cnc(cn1)C(=O)N 27a_100102657272_100000738300 [1,0,0,0,0,0|3,0,0]=4 159 B11R1.3 CNc1ncc(cn1)C(=O)C 27a_100102657272_100000099681 [1,0,0,0,0,0|3,0,0]=4 160 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [1,0,0,0,0,0|2,0,0]=3 161 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [1,0,0,0,0,0|2,0,0]=3 162 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [1,0,0,0,0,0|2,0,0]=3 163 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [1,0,0,0,0,0|2,0,0]=3 164 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [1,0,0,0,0,0|2,0,0]=3 165 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [1,0,0,0,0,0|2,0,0]=3 166 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [1,0,0,0,0,0|3,0,0]=4 168 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [1,0,0,0,0,0|2,0,1]=4 169 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [1,0,0,0,0,0|2,0,1]=4 170 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [1,0,0,0,0,0|2,0,0]=3 171 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [1,0,0,0,0,0|2,0,0]=3 172 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [1,0,0,0,0,0|2,0,0]=3 173 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [1,0,0,0,0,0|2,0,0]=3 174 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [1,0,0,0,0,0|2,0,0]=3 175 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [1,0,0,0,0,0|2,0,0]=3 176 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [1,0,0,0,0,0|2,0,0]=3 177 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [1,0,0,0,0,0|3,0,0]=4 178 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [1,0,0,0,0,0|2,0,1]=4 180 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [1,0,0,0,0,0|2,0,1]=4 181 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [1,0,0,0,0,0|3,0,0]=4 182 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [1,0,0,0,0,0|3,0,0]=4 183 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [1,0,0,0,0,0|3,0,0]=4 186 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [1,0,0,0,0,0|3,0,0]=4 188 B11R1.3 CSc1ccc(cc1)B(O)O 62a_100000754493_200000210301 [1,0,0,0,0,0|2,0,1]=4 189 B11R1.3 CSc1ccc(cc1)B(O)O 62a_200000210301_100000754493 [1,0,0,0,0,0|2,0,1]=4 190 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [1,0,0,0,0,0|2,0,0]=3 191 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [1,0,0,0,0,0|2,0,0]=3 192 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [1,0,0,0,0,0|2,0,0]=3 193 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [1,0,0,0,0,0|2,0,0]=3 194 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [1,0,0,0,0,0|2,0,0]=3 195 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [1,0,0,0,0,0|2,0,0]=3 196 B11R1.3 CSc1ccc(cc1)C(C)C 62a_100000750031_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B11R1.3 CSc1ccc(cc1)C(C)C 62a_200000210301_100000750031 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.3 CSc1ccc(cc1)C(C)O 62a_100000745893_200000210301 [1,0,0,0,0,0|2,0,1]=4 199 B11R1.3 CSc1ccc(cc1)C(C)O 62a_200000210301_100000745893 [1,0,0,0,0,0|2,0,1]=4 200 B11R1.3 CSc1ccc(cc1)N(C)C 62a_100000210421_200000210301 [1,0,0,0,0,0|2,0,0]=3 201 B11R1.3 CSc1ccc(cc1)N(C)C 62a_200000210301_100000210421 [1,0,0,0,0,0|2,0,0]=3 202 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [1,0,0,0,0,0|3,0,0]=4 205 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [1,0,0,0,0,0|3,0,0]=4 207 B11R1.3 CSc1ccc(cn1)N(C)C 62a_100009992925_200000210301 [1,0,0,0,0,0|3,0,0]=4 208 B11R1.3 CSc1ccc(cn1)N(C)C 62a_200000210301_100009992925 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [1,0,0,0,0,0|3,0,0]=4 212 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [1,0,0,0,0,0|3,0,0]=4 213 B11R1.3 CSc1ccc(nc1)N(C)C 27a_100102631434_100009820866 [1,0,0,0,0,0|3,0,0]=4 214 B11R1.3 CSc1ccc(nc1)N(C)C 62a_100011465347_200000210301 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.3 CSc1ccc(nc1)N(C)C 62a_200000210301_100011465347 [1,0,0,0,0,0|3,0,0]=4 216 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [1,0,0,0,0,0|3,0,0]=4 217 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [1,0,0,0,0,0|3,0,0]=4 218 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [1,0,0,0,0,0|3,0,0]=4 219 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [1,0,0,0,0,0|2,0,1]=4 220 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [1,0,0,0,0,0|1,0,0]=2 221 B11R1.3 [13CH3]Nc1ccc(cc1)C(F)F 34a_100020620101_200025704644 [1,0,0,0,0,0|2,0,1]=4 222 B11R1.3 [13CH3]Nc1ccc(cc1)C(F)F 7a_100020620101_200025704644 [1,0,0,0,0,0|2,0,1]=4 223 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200025704644 [1,0,0,0,0,0|1,0,1]=3 224 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200025704644 [1,0,0,0,0,0|1,0,1]=3 225 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [1,0,0,0,0,0|2,0,0]=3 227 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [1,0,0,0,0,0|2,0,1]=4 228 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [1,0,0,0,0,0|2,0,1]=4 229 B11R1.3 [13CH3]Sc1ccc(cc1)B(O)O 62a_100000754493_200025704644 [1,0,0,0,0,0|2,0,1]=4 230 B11R1.3 [13CH3]Sc1ccc(cc1)B(O)O 62a_200025704644_100000754493 [1,0,0,0,0,0|2,0,1]=4 231 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [1,0,0,0,0,0|2,0,0]=3 232 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [1,0,0,0,0,0|2,0,0]=3 233 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [1,0,0,0,0,0|3,0,0]=4 235 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [1,0,0,0,0,0|3,0,0]=4 236 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [1,0,0,0,0,0|3,0,0]=4 237 B13R1.120 C=C(C)c1ccc(c(c1)Br)C(=O)N 271570a_100000694244_200010146565 [0,1,0,0,0,0|2,0,1]=4 238 B13R1.120 C=C(C)c1ccc(c(c1)C)C(=O)C 271570a_100000694244_100012360112 [0,1,0,0,0,0|2,0,1]=4 239 B13R1.120 C=C(C)c1ccc(c(c1)C)C(=O)N 271570a_100000694244_100011327924 [0,1,0,0,0,0|2,0,1]=4 240 B13R1.120 C=C(C)c1ccc(c(c1)F)C(=O)C 271570a_100000694244_100000690205 [0,1,0,0,0,0|2,0,1]=4 241 B13R1.120 C=C(C)c1ccc(c(c1)F)C(=O)N 271570a_100000694244_100000216903 [0,1,0,0,0,0|2,0,1]=4 242 B13R1.120 C=C(C)c1ccc(c(c1)N)C(=O)C 271570a_100000694244_100011590516 [0,1,0,0,0,0|2,0,1]=4 243 B13R1.120 C=C(C)c1ccc(c(c1)N)C(=O)N 271570a_100000694244_100012349972 [0,1,0,0,0,0|2,0,1]=4 244 B13R1.120 C=C(C)c1ccc(c(c1)N)N(C)C 271570a_100000694244_100000737018 [0,1,0,0,0,0|2,0,0]=3 245 B13R1.120 C=C(C)c1ccc(c(c1)O)C(=O)C 271570a_100000694244_100000188348 [0,1,0,0,0,0|2,0,1]=4 246 B13R1.120 C=C(C)c1ccc(c(c1)O)C(=O)N 271570a_100000694244_100011550861 [0,1,0,0,0,0|2,0,1]=4 247 B13R1.120 C=C(C)c1ccc(cc1Br)C(=O)C 271570a_100000694244_100010146554 [0,1,0,0,0,0|2,0,1]=4 248 B13R1.120 C=C(C)c1ccc(cc1Br)C(=O)N 271570a_100000694244_100009814583 [0,1,0,0,0,0|2,0,1]=4 249 B13R1.120 C=C(C)c1ccc(cc1Br)C(C)C 271570a_100000694244_200010212211 [0,1,0,0,0,0|3,0,0]=4 250 B13R1.120 C=C(C)c1ccc(cc1C)C(=O)C 271570a_100000694244_100000697869 [0,1,0,0,0,0|2,0,1]=4 251 B13R1.120 C=C(C)c1ccc(cc1C)C(=O)N 271570a_100000694244_100011218126 [0,1,0,0,0,0|2,0,1]=4 252 B13R1.120 C=C(C)c1ccc(cc1C)N(C)C 271570a_100000694244_100011934168 [0,1,0,0,0,0|2,0,0]=3 253 B13R1.120 C=C(C)c1ccc(cc1F)C(=O)C 271570a_100000694244_100000690002 [0,1,0,0,0,0|2,0,1]=4 254 B13R1.120 C=C(C)c1ccc(cc1F)C(=O)N 271570a_100000694244_100000686215 [0,1,0,0,0,0|2,0,1]=4 255 B13R1.120 C=C(C)c1ccc(cc1N)C(=O)C 271570a_100000694244_100009816534 [0,1,0,0,0,0|2,0,1]=4 256 B13R1.120 C=C(C)c1ccc(cc1O)C(=O)N 271570a_100000694244_100012344895 [0,1,0,0,0,0|2,0,1]=4 257 B13R1.120 CC(=O)c1ccc(c(c1)Br)C(C)C 1458a_100010235942_200000210301 [0,1,0,0,0,0|2,0,0]=3 258 B13R1.120 CC(=O)c1ccc(cc1C)C(=O)N 1458a_100009913687_200000210301 [0,1,0,0,0,0|3,0,0]=4 259 B13R1.120 CC(=O)c1ccc(cc1F)C(C)C 1458a_100011941423_200000210301 [0,1,0,0,0,0|2,0,0]=3 260 B13R1.120 CC(=O)c1ccc(cc1F)N(C)C 27a_100102631434_100000690205 [0,1,0,0,0,0|1,0,0]=2 261 B13R1.120 CC(=O)c1ccc(cc1O)N(C)C 1458a_200000073653_200000210301 [0,1,0,0,0,0|1,0,0]=2 262 B13R1.120 CC(=O)c1cnc(c(c1)C)N(C)C 27a_100102631434_100009864263 [0,1,0,0,0,0|2,0,0]=3 263 B13R1.120 CC(=O)c1cnc(c(c1)O)C(C)C 271570a_203496583355_100010986958 [0,1,0,0,0,0|3,0,0]=4 264 B13R1.120 CC(C)c1ccc(c(c1)F)C(=O)[13CH3] 1458a_100011941423_200025704644 [0,1,0,0,0,0|2,0,0]=3 265 B13R1.120 CC(C)c1ccc(c(c1)O)B(O)O 271570a_203496583355_200010157546 [0,1,0,0,0,0|2,0,1]=4 266 B13R1.120 CC(C)c1ccc(cc1Br)C(=O)[13CH3] 1458a_100010235942_200025704644 [0,1,0,0,0,0|2,0,0]=3 267 B13R1.120 CN(C)c1ccc(c(c1)Br)C(=O)N 27a_100102631434_200010146565 [0,1,0,0,0,0|1,0,0]=2 268 B13R1.120 CN(C)c1ccc(c(c1)F)C(=O)N 27a_100102631434_100000216903 [0,1,0,0,0,0|1,0,0]=2 269 B13R1.120 CN(C)c1ccc(c(c1)O)C(=O)[13CH3] 1458a_200000073653_200025704644 [0,1,0,0,0,0|1,0,0]=2 270 B13R1.120 CN(C)c1ccc(c(n1)N)C(=O)N 27a_100102631434_100009875182 [0,1,0,0,0,0|2,0,0]=3 271 B13R1.120 CN(C)c1ccc(cc1Br)C(=O)N 27a_100102631434_100009814583 [0,1,0,0,0,0|1,0,0]=2 272 B13R1.120 CN(C)c1ccc(cc1Br)[N+](=O)[O-] 269982a_200011534181_200000210301 [0,1,0,0,0,0|1,0,1]=3 273 B13R1.120 CN(C)c1ccc(cc1F)C(=O)N 27a_100102631434_100000686215 [0,1,0,0,0,0|1,0,0]=2 274 B13R1.120 CN(C)c1ccc(cc1F)[N+](=O)[O-] 269982a_100011248812_200000210301 [0,1,0,0,0,0|1,0,1]=3 275 B13R1.120 CN(C)c1ccc(cc1F)[N+](=O)[O-] 34a_100011248812_200000210301 [0,1,0,0,0,0|1,0,1]=3 276 B13R1.120 CN(C)c1cnc(c(c1)F)C(=O)N 27a_100102631434_200010161073 [0,1,0,0,0,0|2,0,0]=3 277 B13R1.120 CN([13CH3])c1ccc(cc1Br)[N+](=O)[O-] 269982a_200011534181_200025704644 [0,1,0,0,0,0|1,0,1]=3 278 B13R1.120 CN([13CH3])c1ccc(cc1F)[N+](=O)[O-] 269982a_100011248812_200025704644 [0,1,0,0,0,0|1,0,1]=3 279 B13R1.120 CN([13CH3])c1ccc(cc1F)[N+](=O)[O-] 34a_100011248812_200025704644 [0,1,0,0,0,0|1,0,1]=3 280 B13R1.120 Cc1cc(ccc1C(=O)N)N(C)C 27a_100102631434_100011327924 [0,1,0,0,0,0|1,0,0]=2 281 B13R1.120 Cc1cc(ccc1C(=O)[13CH3])C(=O)N 1458a_100009913687_200025704644 [0,1,0,0,0,0|3,0,0]=4 282 B13R1.120 Cc1cc(ccc1N(C)C)C(=O)N 27a_100102631434_100011218126 [0,1,0,0,0,0|1,0,0]=2 283 B13R1.120 Cc1cc(ccc1N(C)C)[N+](=O)[O-] 2230a_200011219100_200000210301 [0,1,0,0,0,0|1,0,1]=3 284 B13R1.120 Cc1cc(ccc1N(C)C)[N+](=O)[O-] 269982a_200011219100_200000210301 [0,1,0,0,0,0|1,0,1]=3 285 B13R1.120 Cc1cc(ccc1N(C)C)[N+](=O)[O-] 34a_200011219100_200000210301 [0,1,0,0,0,0|1,0,1]=3 286 B13R1.120 Cc1cc(ccc1N(C)[13CH3])[N+](=O)[O-] 2230a_200011219100_200025704644 [0,1,0,0,0,0|1,0,1]=3 287 B13R1.120 Cc1cc(ccc1N(C)[13CH3])[N+](=O)[O-] 269982a_200011219100_200025704644 [0,1,0,0,0,0|1,0,1]=3 288 B13R1.120 Cc1cc(ccc1N(C)[13CH3])[N+](=O)[O-] 34a_200011219100_200025704644 [0,1,0,0,0,0|1,0,1]=3 289 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)C 2230a_100000686994_200000210301 [0,1,0,0,0,0|1,0,1]=3 290 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)C 269982a_100000686994_200000210301 [0,1,0,0,0,0|1,0,1]=3 291 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)C 34a_100000686994_200000210301 [0,1,0,0,0,0|1,0,1]=3 292 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)[13CH3] 2230a_100000686994_200025704644 [0,1,0,0,0,0|1,0,1]=3 293 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)[13CH3] 269982a_100000686994_200025704644 [0,1,0,0,0,0|1,0,1]=3 294 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])N(C)[13CH3] 34a_100000686994_200025704644 [0,1,0,0,0,0|1,0,1]=3 295 B13R1.120 Cc1cc(ncc1C(=O)N)N(C)C 27a_100102631434_200134614278 [0,1,0,0,0,0|2,0,0]=3 296 B13R1.338 C=C(C)c1ccc(cc1)C(C)(C)C 271570a_100000694244_100011215385 [0,1,0,0,0,0|3,0,0]=4 297 B13R1.338 C=C(C)c1ccc(cc1)C(C)(C)N 271570a_100000694244_100000739617 [0,1,0,0,0,0|3,0,0]=4 298 B13R1.338 C=C(C)c1ccc(cc1)C(C)(C)O 271570a_100000694244_100000753367 [0,1,0,0,0,0|3,0,0]=4 299 B13R1.338 C=C(C)c1ccc(cc1)[Si](C)(C)C 271570a_100000694244_100009813420 [0,1,0,0,0,0|3,0,0]=4 300 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)C 1458a_100000210226_200000210301 [0,1,0,0,0,0|2,0,0]=3 301 B13R1.338 CC(=O)c1ccc(cc1)C(C)(F)F 1458a_100000734349_200000210301 [0,1,0,0,0,0|3,0,0]=4 302 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)C 1458a_100000185160_200000210301 [0,1,0,0,0,0|3,0,0]=4 303 B13R1.338 CC(=O)c1ccc(cc1)[Si](C)(C)C 1458a_100009908145_200000210301 [0,1,0,0,0,0|2,0,0]=3 304 B13R1.338 CC(C)(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210226_200025704644 [0,1,0,0,0,0|2,0,0]=3 305 B13R1.338 CC(F)(F)c1ccc(cc1)C(=O)[13CH3] 1458a_100000734349_200025704644 [0,1,0,0,0,0|3,0,0]=4 306 B13R1.338 CN(C)c1ccc(cc1)C(C)(C)C 2230a_100000220326_200000210301 [0,1,0,0,0,0|2,0,1]=4 307 B13R1.338 CN(C)c1ccc(cc1)C(C)(C)C 269982a_100000220326_200000210301 [0,1,0,0,0,0|2,0,1]=4 308 B13R1.338 CN(C)c1ccc(cc1)C(C)(C)C 34a_100000220326_200000210301 [0,1,0,0,0,0|2,0,1]=4 309 B13R1.338 CN(C)c1ccc(cc1)C(C)(C)C 38a_100000220326_200000210301 [0,1,0,0,0,0|2,0,1]=4 310 B13R1.338 CN(C)c1ccc(cc1)C(C)(C)C 7a_100000220326_200000210301 [0,1,0,0,0,0|2,0,1]=4 311 B13R1.338 CN(C)c1ccc(cc1)C(F)(F)F 269982a_100000220668_200000210301 [0,1,0,0,0,0|2,0,1]=4 312 B13R1.338 CN(C)c1ccc(cc1)C(F)(F)F 34a_100000220668_200000210301 [0,1,0,0,0,0|2,0,1]=4 313 B13R1.338 CN(C)c1ccc(cc1)C(F)(F)F 7a_100000220668_200000210301 [0,1,0,0,0,0|2,0,1]=4 314 B13R1.338 CN(C)c1ccc(cc1)S(=O)(=O)C 269982a_100000744783_200000210301 [0,1,0,0,0,0|1,0,1]=3 315 B13R1.338 CN(C)c1ccc(cc1)S(=O)(=O)C 34a_100000744783_200000210301 [0,1,0,0,0,0|1,0,1]=3 316 B13R1.338 CN(C)c1ccc(cc1)S(=O)(=O)C 7a_100000744783_200000210301 [0,1,0,0,0,0|1,0,1]=3 317 B13R1.338 CN(C)c1ccc(cn1)S(=O)(=O)C 27a_100102631434_100009816761 [0,1,0,0,0,0|2,0,1]=4 318 B13R1.338 CN(C)c1ccc(cn1)S(=O)(=O)N 27a_100102631434_100000164566 [0,1,0,0,0,0|2,0,1]=4 319 B13R1.338 CN([13CH3])c1ccc(cc1)C(C)(C)C 2230a_100000220326_200025704644 [0,1,0,0,0,0|2,0,1]=4 320 B13R1.338 CN([13CH3])c1ccc(cc1)C(C)(C)C 269982a_100000220326_200025704644 [0,1,0,0,0,0|2,0,1]=4 321 B13R1.338 CN([13CH3])c1ccc(cc1)C(C)(C)C 34a_100000220326_200025704644 [0,1,0,0,0,0|2,0,1]=4 322 B13R1.338 CN([13CH3])c1ccc(cc1)C(C)(C)C 38a_100000220326_200025704644 [0,1,0,0,0,0|2,0,1]=4 323 B13R1.338 CN([13CH3])c1ccc(cc1)C(C)(C)C 7a_100000220326_200025704644 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.338 CN([13CH3])c1ccc(cc1)C(F)(F)F 269982a_100000220668_200025704644 [0,1,0,0,0,0|2,0,1]=4 325 B13R1.338 CN([13CH3])c1ccc(cc1)C(F)(F)F 34a_100000220668_200025704644 [0,1,0,0,0,0|2,0,1]=4 326 B13R1.338 CN([13CH3])c1ccc(cc1)C(F)(F)F 7a_100000220668_200025704644 [0,1,0,0,0,0|2,0,1]=4 327 B13R1.338 CN([13CH3])c1ccc(cc1)S(=O)(=O)C 269982a_100000744783_200025704644 [0,1,0,0,0,0|1,0,1]=3 328 B13R1.338 CN([13CH3])c1ccc(cc1)S(=O)(=O)C 34a_100000744783_200025704644 [0,1,0,0,0,0|1,0,1]=3 329 B13R1.338 CN([13CH3])c1ccc(cc1)S(=O)(=O)C 7a_100000744783_200025704644 [0,1,0,0,0,0|1,0,1]=3 330 B13R1.338 CS(=O)(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000185160_200025704644 [0,1,0,0,0,0|3,0,0]=4 331 B13R1.338 C[Si](C)(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100009908145_200025704644 [0,1,0,0,0,0|2,0,0]=3 332 B13R1.537 C=C(C)c1ccc(cc1)C(=O)C#N 271570a_100000694244_100009994572 [0,1,0,0,0,0|2,0,1]=4 333 B13R1.537 C=C(C)c1ccc(cc1)C(=O)C=O 271570a_100000694244_100000725942 [0,1,0,0,0,0|1,0,2]=4 334 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 1458a_200009908186_100000210202 [0,1,0,0,0,0|2,0,1]=4 335 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 271570a_100000694244_100000211647 [0,1,0,0,0,0|2,0,1]=4 336 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CF 1458a_200009908186_100015361967 [0,1,0,0,0,0|2,0,1]=4 337 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CN 271570a_100000694244_100000017248 [0,1,0,0,0,0|2,0,1]=4 338 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CO 271570a_100000694244_100011219529 [0,1,0,0,0,0|1,0,1]=3 339 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 11a_106832991635_200009908186 [0,1,0,0,0,0|2,0,1]=4 340 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 1626a_100102657272_200009908186 [0,1,0,0,0,0|2,0,1]=4 341 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 240690a_100102657272_200009908186 [0,1,0,0,0,0|2,0,1]=4 342 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 271570a_100000694244_100000155074 [0,1,0,0,0,0|2,0,1]=4 343 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 527a_100102657272_200009908186 [0,1,0,0,0,0|2,0,1]=4 344 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NN 271570a_100000694244_100000183614 [0,1,0,0,0,0|2,0,1]=4 345 B13R1.537 C=C(C)c1ccc(cc1)C(=O)OC 271570a_100000694244_100000150774 [0,1,0,0,0,0|1,0,1]=3 346 B13R1.537 C=C(C)c1ccc(cc1)C(C)CC 271570a_100000694244_100011221364 [0,1,0,0,0,0|3,0,0]=4 347 B13R1.537 C=C(C)c1ccc(cc1)C(C)NC 271570a_100000694244_100000231103 [0,1,0,0,0,0|3,0,0]=4 348 B13R1.537 C=C(C)c1ccc(cc1)C(C)OC 271570a_100000694244_100010254937 [0,1,0,0,0,0|3,0,0]=4 349 B13R1.537 C=C(C)c1ccc(cn1)C(=O)OC 271570a_100000694244_100000733799 [0,1,0,0,0,0|2,0,1]=4 350 B13R1.537 C=C(C)c1ccc(nc1)C(=O)OC 271570a_100000694244_100000690920 [0,1,0,0,0,0|2,0,1]=4 351 B13R1.537 CC(C)c1ccc(cc1)C(=O)CF 1458a_100000210772_100015361967 [0,1,0,0,0,0|2,0,0]=3 352 B13R1.537 CC(C)c1ccc(cc1)N(C)CF 269982a_100000688768_100015361967 [0,1,0,0,0,0|2,0,1]=4 353 B13R1.537 CC(C)c1ccc(cc1)N(C)CF 34a_100000688768_100015361967 [0,1,0,0,0,0|2,0,1]=4 354 B13R1.537 CC(C)c1ccc(cc1)N(C)CF 38a_100000688768_100015361967 [0,1,0,0,0,0|2,0,1]=4 355 B13R1.537 CC(O)c1ccc(cc1)C(=O)CF 1458a_100000076921_100015361967 [0,1,0,0,0,0|3,0,0]=4 356 B13R1.537 CC(O[13CH3])c1ccc(cc1)C(=O)N 7a_200010363529_200025704644 [0,1,0,0,0,0|2,0,0]=3 357 B13R1.537 CC(O[13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000246459_200025704644 [0,1,0,0,0,0|2,0,1]=4 358 B13R1.537 CC(O[13CH3])c1ccc(cc1)[N+](=O)[O-] 7a_100000246459_200025704644 [0,1,0,0,0,0|2,0,1]=4 359 B13R1.537 CCC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_100000210202 [0,1,0,0,0,0|3,0,0]=4 360 B13R1.537 CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210202 [0,1,0,0,0,0|2,0,0]=3 361 B13R1.537 CCC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_100000210202 [0,1,0,0,0,0|3,0,0]=4 362 B13R1.537 CCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000210202 [0,1,0,0,0,0|1,0,0]=2 363 B13R1.537 CCC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_100000210202 [0,1,0,0,0,0|3,0,0]=4 364 B13R1.537 CCN(C)c1ccc(cc1)C(=O)O 269956a_100011218868_200000210301 [0,1,0,0,0,0|0,0,0]=1 365 B13R1.537 CCN(C)c1ccc(cc1)C(C)C 2230a_100000688768_100000210202 [0,1,0,0,0,0|2,0,1]=4 366 B13R1.537 CCN(C)c1ccc(cc1)C(C)C 269982a_100000688768_100000204670 [0,1,0,0,0,0|2,0,1]=4 367 B13R1.537 CCN(C)c1ccc(cc1)C(C)C 34a_100000688768_100000210202 [0,1,0,0,0,0|2,0,1]=4 368 B13R1.537 CCN(C)c1ccc(cc1)C(C)C 38a_100000688768_100000204670 [0,1,0,0,0,0|2,0,1]=4 369 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000210202 [0,1,0,0,0,0|1,0,1]=3 370 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156571_200000210301 [0,1,0,0,0,0|1,0,1]=3 371 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000204670 [0,1,0,0,0,0|1,0,1]=3 372 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156571_200000210301 [0,1,0,0,0,0|1,0,1]=3 373 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000210202 [0,1,0,0,0,0|1,0,1]=3 374 B13R1.537 CCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156571_200000210301 [0,1,0,0,0,0|1,0,1]=3 375 B13R1.537 CCN([13CH3])c1ccc(cc1)C(=O)O 269956a_100011218868_200025704644 [0,1,0,0,0,0|0,0,0]=1 376 B13R1.537 CCN([13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000156571_200025704644 [0,1,0,0,0,0|1,0,1]=3 377 B13R1.537 CCN([13CH3])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156571_200025704644 [0,1,0,0,0,0|1,0,1]=3 378 B13R1.537 CCN([13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000156571_200025704644 [0,1,0,0,0,0|1,0,1]=3 379 B13R1.537 CN(C)c1ccc(cc1)C(=O)CF 1458a_100000210873_100015361967 [0,1,0,0,0,0|1,0,0]=2 380 B13R1.537 CN(C)c1ccc(cc1)C(=O)NN 27a_100102631434_100000183614 [0,1,0,0,0,0|1,0,0]=2 381 B13R1.537 CN(C)c1ccc(cn1)C(=O)NN 27a_100102631434_100000189807 [0,1,0,0,0,0|2,0,0]=3 382 B13R1.537 CN(C)c1cnc(cn1)C(=O)NN 27a_100102631434_200012021860 [0,1,0,0,0,0|3,0,0]=4 383 B13R1.537 CN(CF)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100015361967 [0,1,0,0,0,0|1,0,1]=3 384 B13R1.537 CN(CF)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100015361967 [0,1,0,0,0,0|1,0,1]=3 385 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)C 1458a_100011298788_200000210301 [0,1,0,0,0,0|3,0,0]=4 386 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 11a_106832991635_100000230133 [0,1,0,0,0,0|3,0,0]=4 387 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 1626a_100102657272_100000230133 [0,1,0,0,0,0|3,0,0]=4 388 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 240690a_100102657272_100000230133 [0,1,0,0,0,0|3,0,0]=4 389 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100011298788_200025704644 [0,1,0,0,0,0|3,0,0]=4 390 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 11a_106832991635_100000210772 [0,1,0,0,0,0|2,0,0]=3 391 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 1626a_100102657272_100000210772 [0,1,0,0,0,0|2,0,0]=3 392 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 240690a_100102657272_100000210772 [0,1,0,0,0,0|2,0,0]=3 393 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 527a_100102657272_100000210772 [0,1,0,0,0,0|2,0,0]=3 394 B13R1.537 CNC(=O)c1ccc(cc1)C(C)O 240690a_100102657272_100000076921 [0,1,0,0,0,0|3,0,0]=4 395 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 11a_106832991635_100000210873 [0,1,0,0,0,0|1,0,0]=2 396 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 1626a_100102657272_100000210873 [0,1,0,0,0,0|1,0,0]=2 397 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 240690a_100102657272_100000210873 [0,1,0,0,0,0|1,0,0]=2 398 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 27a_100102631434_100000155074 [0,1,0,0,0,0|1,0,0]=2 399 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 527a_100102657272_100000210873 [0,1,0,0,0,0|1,0,0]=2 400 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 1626a_100102657272_200000217594 [0,1,0,0,0,0|3,0,0]=4 401 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 240690a_100102657272_200000217594 [0,1,0,0,0,0|3,0,0]=4 402 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 527a_100102657272_200000217594 [0,1,0,0,0,0|3,0,0]=4 403 B13R1.537 CNC(=O)c1ccc(cn1)N(C)C 27a_100102631434_100011781262 [0,1,0,0,0,0|2,0,0]=3 404 B13R1.537 CNC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000159860 [0,1,0,0,0,0|2,0,0]=3 405 B13R1.537 CNC(=O)c1ncc(cn1)N(C)C 27a_100102631434_200010127873 [0,1,0,0,0,0|3,0,0]=4 406 B13R1.537 CNC(C)c1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000684656 [0,1,0,0,0,0|2,0,1]=4 407 B13R1.537 CNC(C)c1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000684656 [0,1,0,0,0,0|2,0,1]=4 408 B13R1.537 CN[C@@H](C)c1ccc(cc1)C(=O)O 269956a_100020638929_200000210301 [0,1,0,0,0,0|1,0,0]=2 409 B13R1.537 CN[C@@H](C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000008510_200000210301 [0,1,0,0,0,0|2,0,1]=4 410 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C 1458a_100000211811_200000210301 [0,1,0,0,0,0|2,0,0]=3 411 B13R1.537 COC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000211811_200025704644 [0,1,0,0,0,0|2,0,0]=3 412 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 2230a_100000220287_200000210301 [0,1,0,0,0,0|0,0,0]=1 413 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 269982a_100000220287_200000210301 [0,1,0,0,0,0|0,0,0]=1 414 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 34a_100000220287_200000210301 [0,1,0,0,0,0|0,0,0]=1 415 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 2230a_100000220287_200025704644 [0,1,0,0,0,0|0,0,0]=1 416 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 269982a_100000220287_200025704644 [0,1,0,0,0,0|0,0,0]=1 417 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 34a_100000220287_200025704644 [0,1,0,0,0,0|0,0,0]=1 418 B13R1.537 COC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000733799 [0,1,0,0,0,0|1,0,0]=2 419 B13R1.537 COC(=O)c1ccc(nn1)N(C)C 27a_100102631434_100000738951 [0,1,0,0,0,0|2,0,0]=3 420 B13R1.537 COC(=O)c1cnc(cn1)N(C)C 27a_100102631434_100010219404 [0,1,0,0,0,0|2,0,0]=3 421 B13R1.537 COC(=O)c1cnc(nc1)N(C)C 27a_100102631434_100000729365 [0,1,0,0,0,0|2,0,0]=3 422 B13R1.537 COC(C)c1ccc(cc1)C(=O)N 7a_200010363529_200000210301 [0,1,0,0,0,0|2,0,0]=3 423 B13R1.537 COC(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000246459_200000210301 [0,1,0,0,0,0|2,0,1]=4 424 B13R1.537 COC(C)c1ccc(cc1)[N+](=O)[O-] 7a_100000246459_200000210301 [0,1,0,0,0,0|2,0,1]=4 425 B13R1.537 CS(=O)c1ccc(cc1)C(=O)CF 1458a_200000217594_100015361967 [0,1,0,0,0,0|3,0,0]=4 426 B13R1.537 C[C@H](N[13CH3])c1ccc(cc1)C(=O)O 269956a_100020638929_200025704644 [0,1,0,0,0,0|1,0,0]=2 427 B13R1.537 C[C@H](N[13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000008510_200025704644 [0,1,0,0,0,0|2,0,1]=4 428 B13R1.537 NC(=O)c1ccc(cc1)C(=O)CF 1458a_100000230133_100015361967 [0,1,0,0,0,0|3,0,0]=4 429 B13R2.428 C=C(C)c1ccc(cc1)C2CC2 271570a_100000694244_100009820665 [0,0,0,1,0,0|3,0,0]=4 430 B13R2.428 C=C(C)c1ccc(cc1)C2CC2 271570a_100011220607_100000185454 [0,0,0,1,0,0|3,0,0]=4 431 B13R2.428 CC(=O)c1ccc(cc1)C2CC2 1458a_100011688853_200000210301 [0,0,0,1,0,0|2,0,0]=3 432 B13R2.428 CC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000185465 [0,0,0,1,0,0|2,0,0]=3 433 B13R2.428 CC(=O)c1ccc(cn1)C2CC2 271570a_100011220607_100000686046 [0,0,0,1,0,0|3,0,0]=4 434 B13R2.428 CC(=O)c1ccc(nc1)C2CC2 271570a_100011220607_100000684857 [0,0,0,1,0,0|3,0,0]=4 435 B13R2.428 CC(O)c1ccc(cc1)C2CC2 271570a_100011220607_100000745893 [0,0,0,1,0,0|2,0,1]=4 436 B13R2.428 CN(C)c1ccc(cc1)C2CC2 271570a_100011220607_100000210421 [0,0,0,1,0,0|2,0,1]=4 437 B13R2.428 CS(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100009816266 [0,0,0,1,0,0|3,0,0]=4 438 B13R2.428 NC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000162191 [0,0,0,1,0,0|2,0,0]=3 439 B13R2.428 NC(=O)c1ccc(cn1)C2CC2 271570a_100011220607_100011219284 [0,0,0,1,0,0|3,0,0]=4 440 B13R2.428 NC(=O)c1ccc(nc1)C2CC2 271570a_100011220607_100000162237 [0,0,0,1,0,0|3,0,0]=4 441 B13R2.428 OB(O)c1ccc(cc1)C2CC2 271570a_100011220607_100000754493 [0,0,0,1,0,0|2,0,1]=4 442 B13R2.428 [13CH3]C(=O)c1ccc(cc1)C2CC2 1458a_100011688853_200025704644 [0,0,0,1,0,0|2,0,0]=3 443 B11R1.175 CC(=O)c1cnc(s1)N(C)C 27a_100102631434_200010173910 [0,0,0,0,1,0|3,0,0]=4 444 B11R1.175 CN(C)c1nc(co1)C(=O)N 27a_100102631434_100009981048 [0,0,0,0,1,0|3,0,0]=4 445 B11R1.175 CN(C)c1nc(cs1)C(=O)N 27a_100102631434_100010247141 [0,0,0,0,1,0|3,0,0]=4 446 B11R1.175 CN(C)c1ncc(s1)C(=O)N 27a_100102631434_100010220624 [0,0,0,0,1,0|3,0,0]=4 447 B13R1.585 C=C(C)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000185454 [0,0,0,0,0,1|3,0,0]=4 448 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)C 271570a_100000694244_100000691760 [0,0,0,0,0,1|2,0,1]=4 449 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)N 271570a_100000694244_100000162331 [0,0,0,0,0,1|2,0,1]=4 450 B13R1.585 C=C(C)c1ccc(cc1)CC(C)C 271570a_100000694244_100011221366 [0,0,0,0,0,1|3,0,0]=4 451 B13R1.585 C=C(C)c1ccc(cc1)CN(C)C 271570a_100000694244_100000174694 [0,0,0,0,0,1|2,0,0]=3 452 B13R1.585 C=C(C)c1ccc(cc1)NC(=O)C 271570a_100000694244_100000155215 [0,0,0,0,0,1|2,0,1]=4 453 B13R1.585 C=C(C)c1ccc(cc1)NC(=O)N 271570a_100000694244_100000198584 [0,0,0,0,0,1|2,0,1]=4 454 B13R1.585 C=C(C)c1ccc(cc1)NC(C)C 271570a_100000694244_100000219625 [0,0,0,0,0,1|3,0,0]=4 455 B13R1.585 C=C(C)c1ccc(cc1)OC(=O)C 271570a_100000694244_100000002173 [0,0,0,0,0,1|2,0,1]=4 456 B13R1.585 C=C(C)c1ccc(cc1)OC(C)C 271570a_100000694244_100000169947 [0,0,0,0,0,1|3,0,0]=4 457 B13R1.585 C=C(C)c1ccc(cc1)OC(C)C 34a_100009880102_100000210206 [0,0,0,0,0,1|3,0,0]=4 458 B13R1.585 C=C(C)c1ccc(cc1)OC(C)C 7a_100009880102_100000210206 [0,0,0,0,0,1|3,0,0]=4 459 B13R1.585 C=C(C)c1ccc(cc1)SC(=O)C 271570a_100000694244_200009995050 [0,0,0,0,0,1|2,0,1]=4 460 B13R1.585 C=C(C)c1ccc(cc1)SC(C)C 271570a_100000694244_100009811894 [0,0,0,0,0,1|3,0,0]=4 461 B13R1.585 C=C(C)c1ccc(cc1)SC(C)C 62a_100000185454_100000210206 [0,0,0,0,0,1|3,0,0]=4 462 B13R1.585 C=C(C)c1ccc(cc1)SC(C)C 62a_100000210206_100000185454 [0,0,0,0,0,1|3,0,0]=4 463 B13R1.585 C=C(C)c1ccc(cn1)CN(C)C 271570a_100000694244_106446545466 [0,0,0,0,0,1|3,0,0]=4 464 B13R1.585 CC(=Cc1ccc(cc1)B(O)O)C 271570a_100102525489_100000754493 [0,0,0,0,0,1|2,0,1]=4 465 B13R1.585 CC(=Cc1ccc(cc1)C(=O)N)C 271570a_100102525489_100000162191 [0,0,0,0,0,1|2,0,0]=3 466 B13R1.585 CC(=Cc1ccc(cc1)C(C)C)C 271570a_100102525489_100000750031 [0,0,0,0,0,1|3,0,0]=4 467 B13R1.585 CC(=Cc1ccc(cc1)C(C)O)C 271570a_100102525489_100000745893 [0,0,0,0,0,1|2,0,1]=4 468 B13R1.585 CC(=Cc1ccc(cc1)N(C)C)C 271570a_100102525489_100000210421 [0,0,0,0,0,1|2,0,0]=3 469 B13R1.585 CC(=Cc1ccc(cc1)S(=O)C)C 271570a_100102525489_100009816266 [0,0,0,0,0,1|3,0,0]=4 470 B13R1.585 CC(=Cc1ccc(cn1)C(=O)N)C 271570a_100102525489_100000162237 [0,0,0,0,0,1|3,0,0]=4 471 B13R1.585 CC(=Cc1ccc(cn1)N(C)C)C 271570a_100102525489_100009992925 [0,0,0,0,0,1|3,0,0]=4 472 B13R1.585 CC(=Cc1ccc(nc1)C(=O)N)C 271570a_100102525489_100011219284 [0,0,0,0,0,1|3,0,0]=4 473 B13R1.585 CC(=Cc1ccc(nc1)N(C)C)C 271570a_100102525489_100011465347 [0,0,0,0,0,1|3,0,0]=4 474 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000070787_100000756337 [0,0,0,0,0,1|3,0,0]=4 475 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000070787_100000231043 [0,0,0,0,0,1|3,0,0]=4 476 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000070787_100000181262 [0,0,0,0,0,1|2,0,0]=3 477 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_200000210301 [0,0,0,0,0,1|2,0,0]=3 478 B13R1.585 CC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_200000210301 [0,0,0,0,0,1|1,0,0]=2 479 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C 1458a_100000185149_200000210301 [0,0,0,0,0,1|3,0,0]=4 480 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 11a_100000210537_100015343762 [0,0,0,0,0,1|3,0,0]=4 481 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 1626a_100000210537_100015343762 [0,0,0,0,0,1|3,0,0]=4 482 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 22a_100000210537_100000070787 [0,0,0,0,0,1|3,0,0]=4 483 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 527a_100000210537_100103153847 [0,0,0,0,0,1|3,0,0]=4 484 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)[13CH3] 1458a_100000185149_200025704644 [0,0,0,0,0,1|3,0,0]=4 485 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 11a_100000210773_100015343762 [0,0,0,0,0,1|2,0,0]=3 486 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 1626a_100000210773_100015343762 [0,0,0,0,0,1|2,0,0]=3 487 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 22a_100000210773_100000070787 [0,0,0,0,0,1|2,0,0]=3 488 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 527a_100000210773_100103153847 [0,0,0,0,0,1|2,0,0]=3 489 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)O 22a_100011216399_100000070787 [0,0,0,0,0,1|3,0,0]=4 490 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)O 527a_100011216399_100103153847 [0,0,0,0,0,1|3,0,0]=4 491 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 11a_100016997997_100015343762 [0,0,0,0,0,1|1,0,0]=2 492 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 1626a_100016997997_100015343762 [0,0,0,0,0,1|1,0,0]=2 493 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 2230a_100000219403_200000210301 [0,0,0,0,0,1|1,0,0]=2 494 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 22a_100016997997_100000070787 [0,0,0,0,0,1|1,0,0]=2 495 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 269982a_100000219403_200000210301 [0,0,0,0,0,1|1,0,0]=2 496 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 34a_100000219403_200000210301 [0,0,0,0,0,1|1,0,0]=2 497 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 38a_100000219403_200000210301 [0,0,0,0,0,1|1,0,0]=2 498 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 527a_100016997997_100103153847 [0,0,0,0,0,1|1,0,0]=2 499 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 2230a_100000219403_200025704644 [0,0,0,0,0,1|1,0,0]=2 500 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 269982a_100000219403_200025704644 [0,0,0,0,0,1|1,0,0]=2 501 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 34a_100000219403_200025704644 [0,0,0,0,0,1|1,0,0]=2 502 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 38a_100000219403_200025704644 [0,0,0,0,0,1|1,0,0]=2 503 B13R1.585 CC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000185465 [0,0,0,0,0,1|2,0,0]=3 504 B13R1.585 CC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_200000210301 [0,0,0,0,0,1|2,0,0]=3 505 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 1458a_100000749272_200000210301 [0,0,0,0,0,1|1,0,0]=2 506 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000756337 [0,0,0,0,0,1|1,0,0]=2 507 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000756337 [0,0,0,0,0,1|1,0,0]=2 508 B13R1.585 CC(=O)c1ccc(cc1)OC(C)C 1458a_100000182917_200000210301 [0,0,0,0,0,1|2,0,0]=3 509 B13R1.585 CC(=O)c1ccc(cc1)OC(C)C 34a_100000185113_100000210206 [0,0,0,0,0,1|2,0,0]=3 510 B13R1.585 CC(=O)c1ccc(cc1)OC(C)C 7a_100000185113_100000210206 [0,0,0,0,0,1|2,0,0]=3 511 B13R1.585 CC(=O)c1ccc(cc1)SC(C)C 1458a_100000244970_200000210301 [0,0,0,0,0,1|2,0,0]=3 512 B13R1.585 CC(=O)c1ccc(cc1)SC(C)C 62a_100000185465_100000210206 [0,0,0,0,0,1|2,0,0]=3 513 B13R1.585 CC(=O)c1ccc(cc1)SC(C)C 62a_100000210206_100000185465 [0,0,0,0,0,1|2,0,0]=3 514 B13R1.585 CC(=O)c1ccc(cn1)C=C(C)C 271570a_100102525489_100000686046 [0,0,0,0,0,1|3,0,0]=4 515 B13R1.585 CC(=O)c1ccc(cn1)OC(C)C 34a_100012001710_100000210206 [0,0,0,0,0,1|3,0,0]=4 516 B13R1.585 CC(=O)c1ccc(cn1)OC(C)C 7a_100012001710_100000210206 [0,0,0,0,0,1|3,0,0]=4 517 B13R1.585 CC(=O)c1ccc(cn1)SC(C)C 62a_100000210206_100000686046 [0,0,0,0,0,1|3,0,0]=4 518 B13R1.585 CC(=O)c1ccc(cn1)SC(C)C 62a_100000686046_100000210206 [0,0,0,0,0,1|3,0,0]=4 519 B13R1.585 CC(=O)c1ccc(nc1)C=C(C)C 271570a_100102525489_100000684857 [0,0,0,0,0,1|3,0,0]=4 520 B13R1.585 CC(=O)c1ccc(nc1)NC(C)C 27a_100138425928_100000690552 [0,0,0,0,0,1|3,0,0]=4 521 B13R1.585 CC(=O)c1ccc(nc1)SC(C)C 62a_100000210206_100000684857 [0,0,0,0,0,1|3,0,0]=4 522 B13R1.585 CC(=O)c1ccc(nc1)SC(C)C 62a_100000684857_100000210206 [0,0,0,0,0,1|3,0,0]=4 523 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000185289_200025704644 [0,0,0,0,0,1|2,0,0]=3 524 B13R1.585 CC(C)Nc1ccc(cc1)C(=O)N 27a_100138425928_100000162191 [0,0,0,0,0,1|2,0,0]=3 525 B13R1.585 CC(C)Nc1ccc(cc1)C(=O)N 34a_100000210537_100000210206 [0,0,0,0,0,1|2,0,0]=3 526 B13R1.585 CC(C)Nc1ccc(cc1)C(C)O 2230a_100011216399_100000210206 [0,0,0,0,0,1|2,0,1]=4 527 B13R1.585 CC(C)Nc1ccc(cc1)C(C)O 34a_100011216399_100000210206 [0,0,0,0,0,1|2,0,1]=4 528 B13R1.585 CC(C)Nc1ccc(cc1)N(C)C 34a_100016997997_100000210206 [0,0,0,0,0,1|2,0,1]=4 529 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210206 [0,0,0,0,0,1|2,0,1]=4 530 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210206 [0,0,0,0,0,1|2,0,1]=4 531 B13R1.585 CC(C)Nc1ccc(cn1)C(=O)N 27a_100138425928_100000162237 [0,0,0,0,0,1|3,0,0]=4 532 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)N 34a_100000746352_100000210206 [0,0,0,0,0,1|2,0,0]=3 533 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)N 7a_100000746352_100000210206 [0,0,0,0,0,1|2,0,0]=3 534 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)[13CH3] 1458a_100000182917_200025704644 [0,0,0,0,0,1|2,0,0]=3 535 B13R1.585 CC(C)Oc1ccc(cc1)C(C)O 34a_100000754508_100000210206 [0,0,0,0,0,1|2,0,1]=4 536 B13R1.585 CC(C)Oc1ccc(cc1)C(C)O 7a_100000754508_100000210206 [0,0,0,0,0,1|2,0,1]=4 537 B13R1.585 CC(C)Oc1ccc(cc1)N(C)C 34a_100000718910_100000210206 [0,0,0,0,0,1|2,0,1]=4 538 B13R1.585 CC(C)Oc1ccc(cc1)S(=O)C 34a_200000064373_100000210206 [0,0,0,0,0,1|3,0,0]=4 539 B13R1.585 CC(C)Oc1ccc(cc1)S(=O)C 7a_200000064373_100000210206 [0,0,0,0,0,1|3,0,0]=4 540 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210206 [0,0,0,0,0,1|2,0,1]=4 541 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210206 [0,0,0,0,0,1|2,0,1]=4 542 B13R1.585 CC(C)Sc1ccc(cc1)B(O)O 62a_100000210206_100000754493 [0,0,0,0,0,1|2,0,1]=4 543 B13R1.585 CC(C)Sc1ccc(cc1)B(O)O 62a_100000754493_100000210206 [0,0,0,0,0,1|2,0,1]=4 544 B13R1.585 CC(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_100000210206 [0,0,0,0,0,1|2,0,0]=3 545 B13R1.585 CC(C)Sc1ccc(cc1)C(=O)N 62a_100000210206_100000162191 [0,0,0,0,0,1|2,0,0]=3 546 B13R1.585 CC(C)Sc1ccc(cc1)C(=O)[13CH3] 1458a_100000244970_200025704644 [0,0,0,0,0,1|2,0,0]=3 547 B13R1.585 CC(C)Sc1ccc(cc1)C(C)O 62a_100000210206_100000745893 [0,0,0,0,0,1|2,0,1]=4 548 B13R1.585 CC(C)Sc1ccc(cc1)C(C)O 62a_100000745893_100000210206 [0,0,0,0,0,1|2,0,1]=4 549 B13R1.585 CC(C)Sc1ccc(cc1)N(C)C 62a_100000210206_100000210421 [0,0,0,0,0,1|2,0,1]=4 550 B13R1.585 CC(C)Sc1ccc(cc1)N(C)C 62a_100000210421_100000210206 [0,0,0,0,0,1|2,0,1]=4 551 B13R1.585 CC(C)Sc1ccc(cc1)S(=O)C 62a_100009816266_100000210206 [0,0,0,0,0,1|3,0,0]=4 552 B13R1.585 CC(C)Sc1ccc(cn1)C(=O)N 62a_100000162237_100000210206 [0,0,0,0,0,1|3,0,0]=4 553 B13R1.585 CC(C)Sc1ccc(cn1)C(=O)N 62a_100000210206_100000162237 [0,0,0,0,0,1|3,0,0]=4 554 B13R1.585 CC(C)Sc1ccc(nc1)C(=O)N 62a_100000210206_100011219284 [0,0,0,0,0,1|3,0,0]=4 555 B13R1.585 CC(C)Sc1ccc(nc1)C(=O)N 62a_100011219284_100000210206 [0,0,0,0,0,1|3,0,0]=4 556 B13R1.585 CC(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000689720_200025704644 [0,0,0,0,0,1|2,0,0]=3 557 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 2230a_100102631434_100000181262 [0,0,0,0,0,1|2,0,1]=4 558 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 269982a_100102631434_100000181262 [0,0,0,0,0,1|2,0,1]=4 559 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 270004a_100102631434_100000210693 [0,0,0,0,0,1|2,0,1]=4 560 B13R1.585 CN(C)Cc1ccc(cc1)B(O)O 2230a_100102631434_100009813762 [0,0,0,0,0,1|1,0,1]=3 561 B13R1.585 CN(C)Cc1ccc(cc1)B(O)O 269982a_100102631434_100009813762 [0,0,0,0,0,1|1,0,1]=3 562 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)N 2230a_100102631434_100000231043 [0,0,0,0,0,1|1,0,0]=2 563 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)N 269982a_100102631434_100000231043 [0,0,0,0,0,1|1,0,0]=2 564 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)N 270004a_100102631434_100000038677 [0,0,0,0,0,1|1,0,0]=2 565 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000749272_200025704644 [0,0,0,0,0,1|1,0,0]=2 566 B13R1.585 CN(C)Cc1ccc(cc1)C(F)F 2230a_100102631434_200012343607 [0,0,0,0,0,1|2,0,1]=4 567 B13R1.585 CN(C)Cc1ccc(cc1)C(F)F 269982a_100102631434_200012343607 [0,0,0,0,0,1|2,0,1]=4 568 B13R1.585 CN(C)Cc1ccc(cc1)N(C)C 269982a_100000186899_200000210301 [0,0,0,0,0,1|3,0,0]=4 569 B13R1.585 CN(C)Cc1ccc(cc1)N(C)C 270004a_100102631434_100000185837 [0,0,0,0,0,1|3,0,0]=4 570 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_200000210301 [0,0,0,0,0,1|1,0,1]=3 571 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100102631434_100000181861 [0,0,0,0,0,1|1,0,1]=3 572 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_200000210301 [0,0,0,0,0,1|1,0,1]=3 573 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100102631434_100000184243 [0,0,0,0,0,1|1,0,1]=3 574 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 270004a_100102631434_100000189386 [0,0,0,0,0,1|1,0,1]=3 575 B13R1.585 CN(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011218386_200025704644 [0,0,0,0,0,1|1,0,0]=2 576 B13R1.585 CN([13CH3])Cc1ccc(cc1)N(C)C 269982a_100000186899_200025704644 [0,0,0,0,0,1|3,0,0]=4 577 B13R1.585 CN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_200025704644 [0,0,0,0,0,1|1,0,1]=3 578 B13R1.585 CN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_200025704644 [0,0,0,0,0,1|1,0,1]=3 579 B10R1.3 C#Cc1ccc(cc1)NC 34a_100011215031_200000210301 [2,0,0,0,0,0|1,0,1]=4 580 B10R1.3 C#Cc1ccc(cc1)N[13CH3] 34a_100011215031_200025704644 [2,0,0,0,0,0|1,0,1]=4 581 B10R1.3 C=Cc1ccc(cc1)C=O 271570a_100011290941_100000186029 [2,0,0,0,0,0|1,0,1]=4 582 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [2,0,0,0,0,0|2,0,0]=4 583 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [2,0,0,0,0,0|1,0,0]=3 584 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [2,0,0,0,0,0|1,0,0]=3 585 B10R1.3 C=Cc1ccc(cc1)NN 271570a_100011290941_100016988836 [2,0,0,0,0,0|2,0,0]=4 586 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [2,0,0,0,0,0|1,0,0]=3 587 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [2,0,0,0,0,0|2,0,0]=4 588 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [2,0,0,0,0,0|2,0,0]=4 589 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [2,0,0,0,0,0|2,0,0]=4 590 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [2,0,0,0,0,0|2,0,0]=4 591 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [2,0,0,0,0,0|2,0,0]=4 592 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [2,0,0,0,0,0|2,0,0]=4 593 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [2,0,0,0,0,0|2,0,0]=4 594 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [2,0,0,0,0,0|2,0,0]=4 595 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [2,0,0,0,0,0|2,0,0]=4 596 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [2,0,0,0,0,0|2,0,0]=4 597 B10R1.3 C=Cc1ccc(cn1)NC 271570a_100011290941_100000764248 [2,0,0,0,0,0|2,0,0]=4 598 B10R1.3 C=Cc1ccc(nc1)NC 271570a_100011290941_100000741341 [2,0,0,0,0,0|2,0,0]=4 599 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [2,0,0,0,0,0|1,0,1]=4 600 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [2,0,0,0,0,0|1,0,1]=4 601 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [2,0,0,0,0,0|1,0,1]=4 602 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [2,0,0,0,0,0|1,0,1]=4 603 B10R1.3 CNc1ccc(cc1)C#N 34a_100000185469_200000210301 [2,0,0,0,0,0|1,0,1]=4 604 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [2,0,0,0,0,0|0,0,1]=3 605 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [2,0,0,0,0,0|0,0,1]=3 606 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [2,0,0,0,0,0|2,0,0]=4 607 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [2,0,0,0,0,0|2,0,0]=4 608 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [2,0,0,0,0,0|2,0,0]=4 609 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [2,0,0,0,0,0|2,0,0]=4 610 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [2,0,0,0,0,0|2,0,0]=4 611 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [2,0,0,0,0,0|2,0,0]=4 612 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [2,0,0,0,0,0|2,0,0]=4 613 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [2,0,0,0,0,0|2,0,0]=4 614 B10R1.3 CNc1cnc(cn1)C=O 27a_100102657272_100012001714 [2,0,0,0,0,0|2,0,0]=4 615 B10R1.3 CNc1ncc(cn1)C=O 27a_100102657272_100000070856 [2,0,0,0,0,0|2,0,0]=4 616 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [2,0,0,0,0,0|1,0,1]=4 617 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [2,0,0,0,0,0|2,0,0]=4 618 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [2,0,0,0,0,0|1,0,0]=3 619 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [2,0,0,0,0,0|1,0,0]=3 620 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [2,0,0,0,0,0|1,0,1]=4 621 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [2,0,0,0,0,0|1,0,1]=4 622 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [2,0,0,0,0,0|2,0,0]=4 623 B10R1.3 CSc1ccc(cn1)C=O 62a_100000766901_200000210301 [2,0,0,0,0,0|2,0,0]=4 624 B10R1.3 CSc1ccc(cn1)C=O 62a_200000210301_100000766901 [2,0,0,0,0,0|2,0,0]=4 625 B10R1.3 CSc1ccc(nc1)C=O 62a_100000754260_200000210301 [2,0,0,0,0,0|2,0,0]=4 626 B10R1.3 CSc1ccc(nc1)C=O 62a_200000210301_100000754260 [2,0,0,0,0,0|2,0,0]=4 627 B10R1.3 [13CH3]Nc1ccc(cc1)C#N 34a_100000185469_200025704644 [2,0,0,0,0,0|1,0,1]=4 628 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [2,0,0,0,0,0|0,0,1]=3 629 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [2,0,0,0,0,0|0,0,1]=3 630 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [2,0,0,0,0,0|1,0,1]=4 631 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [2,0,0,0,0,0|1,0,0]=3 632 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [2,0,0,0,0,0|1,0,0]=3 633 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [2,0,0,0,0,0|1,0,1]=4 634 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [2,0,0,0,0,0|1,0,1]=4 635 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_100000766901_200025704644 [2,0,0,0,0,0|2,0,0]=4 636 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_200025704644_100000766901 [2,0,0,0,0,0|2,0,0]=4 637 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_100000754260_200025704644 [2,0,0,0,0,0|2,0,0]=4 638 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_200025704644_100000754260 [2,0,0,0,0,0|2,0,0]=4 639 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [2,0,0,0,0,0|2,0,0]=4 640 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [2,0,0,0,0,0|2,0,0]=4 641 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [2,0,0,0,0,0|1,0,1]=4 642 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [2,0,0,0,0,0|1,0,1]=4 643 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [2,0,0,0,0,0|2,0,0]=4 644 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [2,0,0,0,0,0|1,0,0]=3 645 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [2,0,0,0,0,0|2,0,0]=4 646 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [2,0,0,0,0,0|2,0,0]=4 647 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [2,0,0,0,0,0|2,0,0]=4 648 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [2,0,0,0,0,0|2,0,0]=4 649 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [2,0,0,0,0,0|2,0,0]=4 650 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [2,0,0,0,0,0|1,0,0]=3 651 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [2,0,0,0,0,0|2,0,0]=4 652 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [2,0,0,0,0,0|2,0,0]=4 653 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [2,0,0,0,0,0|2,0,0]=4 654 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [2,0,0,0,0,0|1,0,0]=3 655 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [2,0,0,0,0,0|1,0,0]=3 656 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [2,0,0,0,0,0|1,0,0]=3 657 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [2,0,0,0,0,0|1,0,0]=3 658 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [2,0,0,0,0,0|1,0,0]=3 659 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [2,0,0,0,0,0|1,0,0]=3 660 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [2,0,0,0,0,0|1,0,0]=3 661 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [2,0,0,0,0,0|1,0,0]=3 662 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [2,0,0,0,0,0|1,0,0]=3 663 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [2,0,0,0,0,0|1,0,0]=3 664 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [2,0,0,0,0,0|1,0,0]=3 665 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [2,0,0,0,0,0|1,0,0]=3 666 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [2,0,0,0,0,0|0,0,0]=2 667 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [2,0,0,0,0,0|0,0,0]=2 668 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [2,0,0,0,0,0|0,0,0]=2 669 B10R1.13 CN(C)c1ccc(cn1)Br 27a_100102631434_100000686858 [2,0,0,0,0,0|2,0,0]=4 670 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [2,0,0,0,0,0|1,0,0]=3 671 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [2,0,0,0,0,0|1,0,0]=3 672 B10R1.13 CN(C)c1ccc(nn1)O 271570a_203496583355_100000215273 [2,0,0,0,0,0|2,0,0]=4 673 B10R1.13 CN(C)c1cnc(cn1)O 271570a_203496583355_100012356732 [2,0,0,0,0,0|2,0,0]=4 674 B10R1.13 CN(C)c1ncc(cn1)O 271570a_203496583355_100011934759 [2,0,0,0,0,0|2,0,0]=4 675 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [2,0,0,0,0,0|1,0,0]=3 676 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [2,0,0,0,0,0|1,0,0]=3 677 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [2,0,0,0,0,0|1,0,0]=3 678 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [2,0,0,0,0,0|1,0,0]=3 679 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [2,0,0,0,0,0|1,0,0]=3 680 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [2,0,0,0,0,0|1,0,0]=3 681 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [2,0,0,0,0,0|1,0,0]=3 682 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [2,0,0,0,0,0|1,0,0]=3 683 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [2,0,0,0,0,0|1,0,0]=3 684 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [2,0,0,0,0,0|1,0,0]=3 685 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [2,0,0,0,0,0|1,0,0]=3 686 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [2,0,0,0,0,0|1,0,0]=3 687 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [2,0,0,0,0,0|0,0,0]=2 688 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [2,0,0,0,0,0|0,0,0]=2 689 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [2,0,0,0,0,0|2,0,0]=4 690 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [2,0,0,0,0,0|2,0,0]=4 691 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [2,0,0,0,0,0|2,0,0]=4 692 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [2,0,0,0,0,0|1,0,0]=3 693 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [2,0,0,0,0,0|0,0,1]=3 694 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [2,0,0,0,0,0|0,0,1]=3 695 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [2,0,0,0,0,0|0,0,1]=3 696 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [2,0,0,0,0,0|0,0,1]=3 697 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [2,0,0,0,0,0|0,0,1]=3 698 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [2,0,0,0,0,0|0,0,1]=3 699 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [2,0,0,0,0,0|2,0,0]=4 700 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [2,0,0,0,0,0|2,0,0]=4 701 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [2,0,0,0,0,0|2,0,0]=4 702 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [2,0,0,0,0,0|2,0,0]=4 703 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [2,0,0,0,0,0|2,0,0]=4 704 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [2,0,0,0,0,0|2,0,0]=4 705 B12R1.5 C=Cc1ccc(cc1)C(=O)CO 271570a_100011290941_100011219529 [1,1,0,0,0,0|1,0,1]=4 706 B12R1.5 C=Cc1ccc(cc1)C(=O)OC 271570a_100011290941_100000150774 [1,1,0,0,0,0|1,0,1]=4 707 B12R1.5 C=Cc1ccc(cc1)C(C)CC 271570a_100011290941_100011221364 [1,1,0,0,0,0|2,0,0]=4 708 B12R1.5 C=Cc1ccc(cc1)C(C)NC 2230a_200012023546_200000210301 [1,1,0,0,0,0|2,0,0]=4 709 B12R1.5 C=Cc1ccc(cc1)C(C)NC 271570a_100011290941_100000231103 [1,1,0,0,0,0|2,0,0]=4 710 B12R1.5 C=Cc1ccc(cc1)C(C)NC 34a_200012023546_200000210301 [1,1,0,0,0,0|2,0,0]=4 711 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 2230a_200012023546_200025704644 [1,1,0,0,0,0|2,0,0]=4 712 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 34a_200012023546_200025704644 [1,1,0,0,0,0|2,0,0]=4 713 B12R1.5 C=Cc1ccc(cc1)C(C)OC 271570a_100011290941_100010254937 [1,1,0,0,0,0|2,0,0]=4 714 B12R1.5 CC(=NO)c1ccc(cc1)O[13CH3] 34a_100000164205_200025704644 [1,1,0,0,0,0|2,0,0]=4 715 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [1,1,0,0,0,0|2,0,0]=4 716 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [1,1,0,0,0,0|2,0,0]=4 717 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [1,1,0,0,0,0|2,0,0]=4 718 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [1,1,0,0,0,0|2,0,0]=4 719 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [1,1,0,0,0,0|2,0,0]=4 720 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [1,1,0,0,0,0|2,0,0]=4 721 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [1,1,0,0,0,0|2,0,0]=4 722 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [1,1,0,0,0,0|2,0,0]=4 723 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [1,1,0,0,0,0|2,0,0]=4 724 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [1,1,0,0,0,0|2,0,0]=4 725 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [1,1,0,0,0,0|2,0,0]=4 726 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000218877_200000210301 [1,1,0,0,0,0|1,0,1]=4 727 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000739737_100000204670 [1,1,0,0,0,0|1,0,1]=4 728 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000218877_200000210301 [1,1,0,0,0,0|1,0,1]=4 729 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000739737_100000210202 [1,1,0,0,0,0|1,0,1]=4 730 B12R1.5 CCN(C)c1ccc(cc1)C#N 7a_100000218877_200000210301 [1,1,0,0,0,0|1,0,1]=4 731 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [1,1,0,0,0,0|2,0,0]=4 732 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [1,1,0,0,0,0|2,0,0]=4 733 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [1,1,0,0,0,0|2,0,0]=4 734 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 269982a_100000218877_200025704644 [1,1,0,0,0,0|1,0,1]=4 735 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 34a_100000218877_200025704644 [1,1,0,0,0,0|1,0,1]=4 736 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 7a_100000218877_200025704644 [1,1,0,0,0,0|1,0,1]=4 737 B12R1.5 CCc1ccc(cc1)C(=O)CF 1458a_100000211226_100015361967 [1,1,0,0,0,0|2,0,0]=4 738 B12R1.5 CCc1ccc(cc1)C(=O)NC 11a_106832991635_100000211226 [1,1,0,0,0,0|2,0,0]=4 739 B12R1.5 CCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000211226 [1,1,0,0,0,0|2,0,0]=4 740 B12R1.5 CCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000211226 [1,1,0,0,0,0|2,0,0]=4 741 B12R1.5 CCc1ccc(cc1)C(=O)NC 527a_100102657272_100000211226 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.5 CN(CF)c1ccc(cc1)C#N 269982a_100000739737_100015361967 [1,1,0,0,0,0|1,0,1]=4 743 B12R1.5 CN(CF)c1ccc(cc1)C#N 34a_100000739737_100015361967 [1,1,0,0,0,0|1,0,1]=4 744 B12R1.5 CNC(=O)c1ccc(cc1)NC 2230a_100000184841_200000210301 [1,1,0,0,0,0|1,0,0]=3 745 B12R1.5 CNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155074 [1,1,0,0,0,0|1,0,0]=3 746 B12R1.5 CNC(=O)c1ccc(cc1)NC 34a_100000184841_200000210301 [1,1,0,0,0,0|1,0,0]=3 747 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000184841_200025704644 [1,1,0,0,0,0|1,0,0]=3 748 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 34a_100000184841_200025704644 [1,1,0,0,0,0|1,0,0]=3 749 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [1,1,0,0,0,0|2,0,0]=4 750 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [1,1,0,0,0,0|2,0,0]=4 752 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [1,1,0,0,0,0|2,0,0]=4 753 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [1,1,0,0,0,0|2,0,0]=4 754 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [1,1,0,0,0,0|2,0,0]=4 755 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [1,1,0,0,0,0|2,0,0]=4 756 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [1,1,0,0,0,0|2,0,0]=4 757 B12R1.5 CNC(=O)c1ccc(cc1)SC 11a_106832991635_100000189692 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.5 CNC(=O)c1ccc(cc1)SC 1626a_100102657272_100000189692 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.5 CNC(=O)c1ccc(cc1)SC 240690a_100102657272_100000189692 [1,1,0,0,0,0|2,0,0]=4 760 B12R1.5 CNC(=O)c1ccc(cc1)SC 527a_100102657272_100000189692 [1,1,0,0,0,0|2,0,0]=4 761 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_100000155074_200000210301 [1,1,0,0,0,0|2,0,0]=4 762 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155074 [1,1,0,0,0,0|2,0,0]=4 763 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155074_200025704644 [1,1,0,0,0,0|2,0,0]=4 764 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155074 [1,1,0,0,0,0|2,0,0]=4 765 B12R1.5 CNC(=O)c1ccc(cn1)NC 27a_100102657272_100011781262 [1,1,0,0,0,0|2,0,0]=4 766 B12R1.5 CNC(=O)c1ccc(nc1)NC 27a_100102657272_100000159860 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [1,1,0,0,0,0|1,0,1]=4 768 B12R1.5 CNc1ccc(cc1)C(=O)NN 27a_100102657272_100000183614 [1,1,0,0,0,0|1,0,0]=3 769 B12R1.5 CNc1ccc(cn1)C(=O)NN 27a_100102657272_100000189807 [1,1,0,0,0,0|2,0,0]=4 770 B12R1.5 CNc1ccc(cn1)C(=O)OC 27a_100102657272_100000733799 [1,1,0,0,0,0|1,0,0]=3 771 B12R1.5 CNc1ccc(nn1)C(=O)OC 27a_100102657272_100000738951 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.5 CNc1cnc(cn1)C(=O)OC 27a_100102657272_100010219404 [1,1,0,0,0,0|2,0,0]=4 773 B12R1.5 CNc1ncc(cn1)C(=O)OC 27a_100102657272_100000729365 [1,1,0,0,0,0|2,0,0]=4 774 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [1,1,0,0,0,0|1,0,0]=3 775 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [1,1,0,0,0,0|1,0,0]=3 776 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [1,1,0,0,0,0|1,0,0]=3 777 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [1,1,0,0,0,0|1,0,0]=3 778 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [1,1,0,0,0,0|1,0,0]=3 779 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [1,1,0,0,0,0|1,0,0]=3 780 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [1,1,0,0,0,0|1,0,0]=3 781 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [1,1,0,0,0,0|1,0,0]=3 782 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [1,1,0,0,0,0|2,0,0]=4 783 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [1,1,0,0,0,0|2,0,0]=4 784 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [1,1,0,0,0,0|2,0,0]=4 785 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_100102712061_200000210301 [1,1,0,0,0,0|2,0,0]=4 787 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_200000210301_100102712061 [1,1,0,0,0,0|2,0,0]=4 788 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_100102712061_200025704644 [1,1,0,0,0,0|2,0,0]=4 789 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100102712061 [1,1,0,0,0,0|2,0,0]=4 790 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_100000733799_200000210301 [1,1,0,0,0,0|2,0,0]=4 791 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_200000210301_100000733799 [1,1,0,0,0,0|2,0,0]=4 792 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_100000733799_200025704644 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000733799 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.5 COc1ccc(cc1)C(=NO)C 34a_100000164205_200000210301 [1,1,0,0,0,0|2,0,0]=4 795 B12R1.5 COc1ccc(cc1)C(=NO)N 34a_100000231063_200000210301 [1,1,0,0,0,0|2,0,0]=4 796 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [1,1,0,0,0,0|2,0,0]=4 797 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [1,1,0,0,0,0|2,0,0]=4 798 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [1,1,0,0,0,0|2,0,0]=4 799 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [1,1,0,0,0,0|2,0,0]=4 800 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [1,1,0,0,0,0|2,0,0]=4 801 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [1,1,0,0,0,0|2,0,0]=4 802 B12R1.5 COc1ccc(cc1)N(C)CF 269982a_100000220023_100015361967 [1,1,0,0,0,0|2,0,0]=4 803 B12R1.5 COc1ccc(cc1)N(C)CF 34a_100000220023_100015361967 [1,1,0,0,0,0|2,0,0]=4 804 B12R1.5 CSc1ccc(cc1)C(=O)C#N 62a_200000210301_100009994572 [1,1,0,0,0,0|2,0,0]=4 805 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000210301 [1,1,0,0,0,0|1,0,1]=4 806 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_200000210301_100000725942 [1,1,0,0,0,0|1,0,1]=4 807 B12R1.5 CSc1ccc(cc1)C(=O)CF 1458a_100000189692_100015361967 [1,1,0,0,0,0|2,0,0]=4 808 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_100000017248_200000210301 [1,1,0,0,0,0|2,0,0]=4 809 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_200000210301_100000017248 [1,1,0,0,0,0|2,0,0]=4 810 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_100011219529_200000210301 [1,1,0,0,0,0|1,0,0]=3 811 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_200000210301_100011219529 [1,1,0,0,0,0|1,0,0]=3 812 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_100000183614_200000210301 [1,1,0,0,0,0|2,0,0]=4 813 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_200000210301_100000183614 [1,1,0,0,0,0|2,0,0]=4 814 B12R1.5 [13CH3]Oc1ccc(cc1)C(=NO)N 34a_100000231063_200025704644 [1,1,0,0,0,0|2,0,0]=4 815 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [1,1,0,0,0,0|2,0,0]=4 816 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [1,1,0,0,0,0|2,0,0]=4 817 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [1,1,0,0,0,0|2,0,0]=4 819 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [1,1,0,0,0,0|2,0,0]=4 820 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C#N 62a_200025704644_100009994572 [1,1,0,0,0,0|2,0,0]=4 821 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200025704644 [1,1,0,0,0,0|1,0,1]=4 822 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_200025704644_100000725942 [1,1,0,0,0,0|1,0,1]=4 823 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_100000017248_200025704644 [1,1,0,0,0,0|2,0,0]=4 824 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_200025704644_100000017248 [1,1,0,0,0,0|2,0,0]=4 825 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_100011219529_200025704644 [1,1,0,0,0,0|1,0,0]=3 826 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_200025704644_100011219529 [1,1,0,0,0,0|1,0,0]=3 827 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_100000183614_200025704644 [1,1,0,0,0,0|2,0,0]=4 828 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_200025704644_100000183614 [1,1,0,0,0,0|2,0,0]=4 829 B12R1.6 C=Cc1ccc(cc1)C(C)(C)C 271570a_100011290941_100011215385 [1,1,0,0,0,0|2,0,0]=4 830 B12R1.6 C=Cc1ccc(cc1)C(C)(C)N 271570a_100011290941_100000739617 [1,1,0,0,0,0|2,0,0]=4 831 B12R1.6 C=Cc1ccc(cc1)C(C)(C)O 271570a_100011290941_100000753367 [1,1,0,0,0,0|2,0,0]=4 832 B12R1.6 C=Cc1ccc(cc1)[Si](C)(C)C 271570a_100011290941_100009813420 [1,1,0,0,0,0|2,0,0]=4 833 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 34a_100000195502_200000210301 [1,1,0,0,0,0|1,0,1]=4 834 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 7a_100000195502_200000210301 [1,1,0,0,0,0|1,0,1]=4 835 B12R1.6 CNc1ccc(cc1)S(=O)(=O)N 34a_100000182716_200000210301 [1,1,0,0,0,0|1,0,1]=4 836 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 34a_100000195502_200025704644 [1,1,0,0,0,0|1,0,1]=4 837 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 7a_100000195502_200025704644 [1,1,0,0,0,0|1,0,1]=4 838 B12R1.6 [13CH3]Nc1ccc(cc1)S(=O)(=O)N 34a_100000182716_200025704644 [1,1,0,0,0,0|1,0,1]=4 839 B12R1.48 C=C(C)c1ccc(c(c1)Br)C=O 271570a_100000694244_100010185650 [1,1,0,0,0,0|1,0,1]=4 840 B12R1.48 C=C(C)c1ccc(c(c1)C)C=O 271570a_100000694244_100000687586 [1,1,0,0,0,0|1,0,1]=4 841 B12R1.48 C=C(C)c1ccc(c(c1)C)NC 271570a_100000694244_100000221803 [1,1,0,0,0,0|2,0,0]=4 842 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C=O 271570a_100000694244_100000727542 [1,1,0,0,0,0|1,0,1]=4 843 B12R1.48 C=C(C)c1ccc(c(c1)F)C=O 271570a_100000694244_100000211676 [1,1,0,0,0,0|1,0,1]=4 844 B12R1.48 C=C(C)c1ccc(c(c1)F)NC 271570a_100000694244_100000743884 [1,1,0,0,0,0|2,0,0]=4 845 B12R1.48 C=C(C)c1ccc(c(c1)N)C=O 271570a_100000694244_100009814810 [1,1,0,0,0,0|1,0,1]=4 846 B12R1.48 C=C(C)c1ccc(c(c1)N)NC 271570a_100000694244_100000741790 [1,1,0,0,0,0|2,0,0]=4 847 B12R1.48 C=C(C)c1ccc(c(c1)O)C=O 271570a_100000694244_100011277552 [1,1,0,0,0,0|1,0,1]=4 848 B12R1.48 C=Cc1ccc(cc1Br)C(C)C 271570a_100011290941_200010212211 [1,1,0,0,0,0|2,0,0]=4 849 B12R1.48 C=Cc1ccc(cc1C)N(C)C 271570a_100011290941_100011934168 [1,1,0,0,0,0|1,0,0]=3 850 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [1,1,0,0,0,0|2,0,0]=4 851 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [1,1,0,0,0,0|2,0,0]=4 852 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100010146554_200025704644 [1,1,0,0,0,0|2,0,0]=4 853 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100010146554 [1,1,0,0,0,0|2,0,0]=4 854 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [1,1,0,0,0,0|2,0,0]=4 855 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [1,1,0,0,0,0|2,0,0]=4 856 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [1,1,0,0,0,0|2,0,0]=4 861 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [1,1,0,0,0,0|2,0,0]=4 862 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000690002_200025704644 [1,1,0,0,0,0|2,0,0]=4 863 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000690002 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.48 CC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100009816534_200025704644 [1,1,0,0,0,0|2,0,0]=4 867 B12R1.48 CC(C)c1ccc(c(c1)O)C=O 271570a_203496583355_100010158967 [1,1,0,0,0,0|1,0,0]=3 868 B12R1.48 CCc1ccc(cc1Br)C(=O)C 1458a_100012340589_200000210301 [1,1,0,0,0,0|2,0,0]=4 869 B12R1.48 CCc1ccc(cc1Br)C(=O)[13CH3] 1458a_100012340589_200025704644 [1,1,0,0,0,0|2,0,0]=4 870 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [1,1,0,0,0,0|2,0,0]=4 871 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.48 CN(C)c1ccc(c(c1)Br)C#N 27a_100102631434_100012349582 [1,1,0,0,0,0|1,0,1]=4 873 B12R1.48 CN(C)c1ccc(c(c1)Br)N[13CH3] 34a_200013039233_200025704644 [1,1,0,0,0,0|2,0,0]=4 874 B12R1.48 CN(C)c1ccc(c(c1)F)C#N 27a_100102631434_100000037869 [1,1,0,0,0,0|1,0,1]=4 875 B12R1.48 CN(C)c1ccc(c(n1)F)C=O 27a_100102631434_100010064369 [1,1,0,0,0,0|1,0,0]=3 876 B12R1.48 CN(C)c1ccc(c(n1)F)CO 27a_100102631434_100010065253 [1,1,0,0,0,0|1,0,1]=4 877 B12R1.48 CNc1ccc(cc1Br)C(=O)N 27a_100102657272_100009814583 [1,1,0,0,0,0|1,0,0]=3 878 B12R1.48 CNc1ccc(cc1Br)N(C)C 34a_200013039233_200000210301 [1,1,0,0,0,0|2,0,0]=4 879 B12R1.48 CNc1ccc(cc1C)C(=O)N 27a_100102657272_100011218126 [1,1,0,0,0,0|1,0,0]=3 880 B12R1.48 CNc1ccc(cc1C)C(=O)N 34a_100000746439_200000210301 [1,1,0,0,0,0|1,0,0]=3 881 B12R1.48 CNc1ccc(cc1C)C(=O)N 7a_100000746439_200000210301 [1,1,0,0,0,0|1,0,0]=3 882 B12R1.48 CNc1ccc(cc1C)N(C)C 34a_100000246174_200000210301 [1,1,0,0,0,0|2,0,0]=4 883 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 2230a_100000184110_200000210301 [1,1,0,0,0,0|1,0,1]=4 884 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 34a_100000184110_200000210301 [1,1,0,0,0,0|1,0,1]=4 885 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 7a_100000184110_200000210301 [1,1,0,0,0,0|1,0,1]=4 886 B12R1.48 CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_200000210301 [1,1,0,0,0,0|1,0,1]=4 887 B12R1.48 CNc1ccc(cc1F)C(=O)N 27a_100102657272_100000686215 [1,1,0,0,0,0|1,0,0]=3 888 B12R1.48 CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_200000210301 [1,1,0,0,0,0|1,0,1]=4 889 B12R1.48 CNc1ncc(cc1C)C(=O)C 27a_100102657272_100009864263 [1,1,0,0,0,0|2,0,0]=4 890 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [1,1,0,0,0,0|2,0,0]=4 891 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [1,1,0,0,0,0|2,0,0]=4 892 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [1,1,0,0,0,0|2,0,0]=4 893 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [1,1,0,0,0,0|2,0,0]=4 894 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [1,1,0,0,0,0|2,0,0]=4 895 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [1,1,0,0,0,0|2,0,0]=4 896 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [1,1,0,0,0,0|2,0,0]=4 897 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [1,1,0,0,0,0|2,0,0]=4 898 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [1,1,0,0,0,0|2,0,0]=4 899 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [1,1,0,0,0,0|2,0,0]=4 900 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [1,1,0,0,0,0|2,0,0]=4 901 B12R1.48 COc1ccc(cc1Cl)C(=O)N 34a_200000192832_200000210301 [1,1,0,0,0,0|2,0,0]=4 902 B12R1.48 COc1ccc(cc1Cl)C(=O)N 7a_200000192832_200000210301 [1,1,0,0,0,0|2,0,0]=4 903 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [1,1,0,0,0,0|2,0,0]=4 904 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [1,1,0,0,0,0|2,0,0]=4 905 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [1,1,0,0,0,0|2,0,0]=4 906 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [1,1,0,0,0,0|2,0,0]=4 907 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [1,1,0,0,0,0|2,0,0]=4 908 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.48 COc1ccc(cc1I)N(C)C 269982a_114948341033_200000210301 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.48 COc1ccc(cc1I)N(C)C 34a_114948341033_200000210301 [1,1,0,0,0,0|2,0,0]=4 912 B12R1.48 COc1ccc(cc1I)N(C)C 38a_114948341033_200000210301 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 269982a_114948341033_200025704644 [1,1,0,0,0,0|2,0,0]=4 914 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 34a_114948341033_200025704644 [1,1,0,0,0,0|2,0,0]=4 915 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 38a_114948341033_200025704644 [1,1,0,0,0,0|2,0,0]=4 916 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [1,1,0,0,0,0|2,0,0]=4 917 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [1,1,0,0,0,0|2,0,0]=4 918 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [1,1,0,0,0,0|2,0,0]=4 919 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [1,1,0,0,0,0|2,0,0]=4 920 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [1,1,0,0,0,0|2,0,0]=4 921 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_100010146554_200000210301 [1,1,0,0,0,0|2,0,0]=4 922 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_200000210301_100010146554 [1,1,0,0,0,0|2,0,0]=4 923 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_100009814583_200000210301 [1,1,0,0,0,0|2,0,0]=4 924 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_200000210301_100009814583 [1,1,0,0,0,0|2,0,0]=4 925 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [1,1,0,0,0,0|2,0,0]=4 927 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_100011218126_200000210301 [1,1,0,0,0,0|2,0,0]=4 928 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_200000210301_100011218126 [1,1,0,0,0,0|2,0,0]=4 929 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_100011934168_200000210301 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_200000210301_100011934168 [1,1,0,0,0,0|2,0,0]=4 931 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_100000690002_200000210301 [1,1,0,0,0,0|2,0,0]=4 932 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_200000210301_100000690002 [1,1,0,0,0,0|2,0,0]=4 933 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_100000686215_200000210301 [1,1,0,0,0,0|2,0,0]=4 934 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_200000210301_100000686215 [1,1,0,0,0,0|2,0,0]=4 935 B12R1.48 CSc1ccc(cc1N)C(=O)C 62a_100009816534_200000210301 [1,1,0,0,0,0|2,0,0]=4 936 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_100012344895_200000210301 [1,1,0,0,0,0|2,0,0]=4 937 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_200000210301_100012344895 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 34a_100000746439_200025704644 [1,1,0,0,0,0|1,0,0]=3 939 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 7a_100000746439_200025704644 [1,1,0,0,0,0|1,0,0]=3 940 B12R1.48 Cc1cc(ccc1N[13CH3])N(C)C 34a_100000246174_200025704644 [1,1,0,0,0,0|2,0,0]=4 941 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 2230a_100000184110_200025704644 [1,1,0,0,0,0|1,0,1]=4 942 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 34a_100000184110_200025704644 [1,1,0,0,0,0|1,0,1]=4 943 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 7a_100000184110_200025704644 [1,1,0,0,0,0|1,0,1]=4 944 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_100011218126_200025704644 [1,1,0,0,0,0|2,0,0]=4 945 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_200025704644_100011218126 [1,1,0,0,0,0|2,0,0]=4 946 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_100011934168_200025704644 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_200025704644_100011934168 [1,1,0,0,0,0|2,0,0]=4 948 B12R1.48 [13CH3]Nc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_200025704644 [1,1,0,0,0,0|1,0,1]=4 949 B12R1.48 [13CH3]Nc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_200025704644 [1,1,0,0,0,0|1,0,1]=4 950 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 34a_200000192832_200025704644 [1,1,0,0,0,0|2,0,0]=4 951 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 7a_200000192832_200025704644 [1,1,0,0,0,0|2,0,0]=4 952 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_100009814583_200025704644 [1,1,0,0,0,0|2,0,0]=4 953 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_200025704644_100009814583 [1,1,0,0,0,0|2,0,0]=4 954 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_100000686215_200025704644 [1,1,0,0,0,0|2,0,0]=4 955 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_200025704644_100000686215 [1,1,0,0,0,0|2,0,0]=4 956 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_100012344895_200025704644 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_200025704644_100012344895 [1,1,0,0,0,0|2,0,0]=4 958 B12R1.113 C=C(C)c1ccc(cc1)CC=O 271570a_100000694244_100011361690 [1,1,0,0,0,0|1,0,1]=4 959 B12R1.113 C=C(C)c1ccc(cc1)CNC 26a_100102657272_100009880102 [1,1,0,0,0,0|2,0,0]=4 960 B12R1.113 C=C(C)c1ccc(cc1)CNC 271570a_100000694244_100000180866 [1,1,0,0,0,0|2,0,0]=4 961 B12R1.113 C=C(C)c1ccc(cc1)NCC 271570a_100000694244_100000219632 [1,1,0,0,0,0|2,0,0]=4 962 B12R1.113 C=C=Cc1ccc(cc1)C(C)C 271570a_100015277604_100000750031 [1,1,0,0,0,0|2,0,0]=4 963 B12R1.113 C=C=Cc1ccc(cc1)N(C)C 271570a_100015277604_100000210421 [1,1,0,0,0,0|1,0,0]=3 964 B12R1.113 C=C=Cc1ccc(cn1)N(C)C 271570a_100015277604_100009992925 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.113 C=C=Cc1ccc(nc1)N(C)C 271570a_100015277604_100011465347 [1,1,0,0,0,0|2,0,0]=4 966 B12R1.113 CC#Cc1ccc(cc1)C(=O)C 1458a_100009923575_200000210301 [1,1,0,0,0,0|2,0,0]=4 967 B12R1.113 CC#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100009923575_200025704644 [1,1,0,0,0,0|2,0,0]=4 968 B12R1.113 CC(=O)c1ccc(cc1)CCO 1458a_100000078963_200000210301 [1,1,0,0,0,0|2,0,0]=4 969 B12R1.113 CC(=O)c1ccc(cc1)CO[13CH3] 7a_100000082505_200025704644 [1,1,0,0,0,0|2,0,0]=4 970 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_100000756337_200025704644 [1,1,0,0,0,0|2,0,0]=4 971 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000756337 [1,1,0,0,0,0|2,0,0]=4 972 B12R1.113 CC(=O)c1ccc(cc1)OCF 34a_100000185113_100015361967 [1,1,0,0,0,0|2,0,0]=4 973 B12R1.113 CC(=O)c1ccc(cc1)OCF 7a_100000185113_100015361967 [1,1,0,0,0,0|2,0,0]=4 974 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100000185465_100015361967 [1,1,0,0,0,0|2,0,0]=4 975 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100015361967_100000185465 [1,1,0,0,0,0|2,0,0]=4 976 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 34a_100000181325_200025704644 [1,1,0,0,0,0|1,0,1]=4 977 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 7a_100000181325_200025704644 [1,1,0,0,0,0|1,0,1]=4 978 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 2230a_200000048501_200025704644 [1,1,0,0,0,0|1,0,1]=4 979 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 34a_200000048501_200025704644 [1,1,0,0,0,0|1,0,1]=4 980 B12R1.113 CC(O)c1ccc(cc1)NCF 34a_100011216399_100015361967 [1,1,0,0,0,0|1,0,1]=4 981 B12R1.113 CC=Cc1ccc(cc1)C(=O)C 271570a_100016259895_100000185465 [1,1,0,0,0,0|2,0,0]=4 982 B12R1.113 CC=Cc1ccc(cc1)C(=O)N 271570a_100016259895_100000162191 [1,1,0,0,0,0|2,0,0]=4 983 B12R1.113 CC=Cc1ccc(cc1)C(C)C 271570a_100016259895_100000750031 [1,1,0,0,0,0|2,0,0]=4 984 B12R1.113 CC=Cc1ccc(cc1)N(C)C 271570a_100016259895_100000210421 [1,1,0,0,0,0|1,0,0]=3 985 B12R1.113 CC=Cc1ccc(cn1)N(C)C 271570a_100016259895_100009992925 [1,1,0,0,0,0|2,0,0]=4 986 B12R1.113 CC=Cc1ccc(nc1)N(C)C 271570a_100016259895_100011465347 [1,1,0,0,0,0|2,0,0]=4 987 B12R1.113 CCCc1ccc(cc1)C(=O)C 1458a_100011207308_200000210301 [1,1,0,0,0,0|2,0,0]=4 988 B12R1.113 CCCc1ccc(cc1)C(=O)[13CH3] 1458a_100011207308_200025704644 [1,1,0,0,0,0|2,0,0]=4 989 B12R1.113 CCNc1ccc(cc1)C(=O)N 27a_100015525214_100000162191 [1,1,0,0,0,0|1,0,0]=3 990 B12R1.113 CCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210202 [1,1,0,0,0,0|1,0,0]=3 991 B12R1.113 CCNc1ccc(cc1)C(C)O 2230a_100011216399_100000210202 [1,1,0,0,0,0|1,0,1]=4 992 B12R1.113 CCNc1ccc(cc1)C(C)O 34a_100011216399_100000210202 [1,1,0,0,0,0|1,0,1]=4 993 B12R1.113 CCNc1ccc(cc1)N(C)C 34a_100016997997_100000210202 [1,1,0,0,0,0|1,0,1]=4 994 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210202 [1,1,0,0,0,0|1,0,1]=4 995 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210202 [1,1,0,0,0,0|1,0,1]=4 996 B12R1.113 CCNc1ccc(cn1)C(=O)C 27a_100015525214_100000690552 [1,1,0,0,0,0|2,0,0]=4 997 B12R1.113 CCNc1ccc(cn1)C(=O)N 27a_100015525214_100000162237 [1,1,0,0,0,0|2,0,0]=4 998 B12R1.113 CCOc1ccc(cc1)C(=O)C 1458a_100000181891_200000210301 [1,1,0,0,0,0|2,0,0]=4 999 B12R1.113 CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210202 [1,1,0,0,0,0|2,0,0]=4 1000 B12R1.113 CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210202 [1,1,0,0,0,0|2,0,0]=4 1001 B12R1.113 CCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210202 [1,1,0,0,0,0|2,0,0]=4 1002 B12R1.113 CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210202 [1,1,0,0,0,0|2,0,0]=4 1003 B12R1.113 CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000181891_200025704644 [1,1,0,0,0,0|2,0,0]=4 1004 B12R1.113 CCOc1ccc(cc1)N(C)C 2230a_100025784348_200000210301 [1,1,0,0,0,0|1,0,1]=4 1005 B12R1.113 CCOc1ccc(cc1)N(C)C 269982a_100025784348_200000210301 [1,1,0,0,0,0|1,0,1]=4 1006 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100000718910_100000210202 [1,1,0,0,0,0|1,0,1]=4 1007 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100025784348_200000210301 [1,1,0,0,0,0|1,0,1]=4 1008 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 2230a_100025784348_200025704644 [1,1,0,0,0,0|1,0,1]=4 1009 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 269982a_100025784348_200025704644 [1,1,0,0,0,0|1,0,1]=4 1010 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 34a_100025784348_200025704644 [1,1,0,0,0,0|1,0,1]=4 1011 B12R1.113 CCSc1ccc(cc1)C(=O)C 1458a_100000244969_200000210301 [1,1,0,0,0,0|2,0,0]=4 1012 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210202 [1,1,0,0,0,0|2,0,0]=4 1013 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000210202_100000185465 [1,1,0,0,0,0|2,0,0]=4 1014 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210202 [1,1,0,0,0,0|2,0,0]=4 1015 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000210202_100000162191 [1,1,0,0,0,0|2,0,0]=4 1016 B12R1.113 CCSc1ccc(cc1)C(=O)[13CH3] 1458a_100000244969_200025704644 [1,1,0,0,0,0|2,0,0]=4 1017 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210202_100000210421 [1,1,0,0,0,0|1,0,1]=4 1018 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210421_100000210202 [1,1,0,0,0,0|1,0,1]=4 1019 B12R1.113 CN(C)c1ccc(cc1)CO[13CH3] 34a_100000238745_200025704644 [1,1,0,0,0,0|0,0,1]=3 1020 B12R1.113 CN(C)c1ccc(cc1)NCF 34a_100016997997_100015361967 [1,1,0,0,0,0|1,0,1]=4 1021 B12R1.113 CN(C)c1ccc(cc1)OCF 34a_100000718910_100015361967 [1,1,0,0,0,0|1,0,1]=4 1022 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100000210421_100015361967 [1,1,0,0,0,0|1,0,1]=4 1023 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100015361967_100000210421 [1,1,0,0,0,0|1,0,1]=4 1024 B12R1.113 CNCc1ccc(cc1)B(O)O 2230a_106832991635_100009813762 [1,1,0,0,0,0|1,0,1]=4 1025 B12R1.113 CNCc1ccc(cc1)B(O)O 34a_100102657272_100009813762 [1,1,0,0,0,0|1,0,1]=4 1026 B12R1.113 CNCc1ccc(cc1)B(O)O 7a_106832991635_100009813762 [1,1,0,0,0,0|1,0,1]=4 1027 B12R1.113 CNCc1ccc(cc1)C(=O)C 2230a_106832991635_100000756337 [1,1,0,0,0,0|1,0,0]=3 1028 B12R1.113 CNCc1ccc(cc1)C(=O)C 26a_100102657272_100000185113 [1,1,0,0,0,0|1,0,0]=3 1029 B12R1.113 CNCc1ccc(cc1)C(=O)C 34a_100102657272_100000756337 [1,1,0,0,0,0|1,0,0]=3 1030 B12R1.113 CNCc1ccc(cc1)C(=O)C 7a_106832991635_100000756337 [1,1,0,0,0,0|1,0,0]=3 1031 B12R1.113 CNCc1ccc(cc1)C(=O)N 207a_100102657272_100000038677 [1,1,0,0,0,0|1,0,0]=3 1032 B12R1.113 CNCc1ccc(cc1)C(=O)N 2230a_106832991635_100000231043 [1,1,0,0,0,0|1,0,0]=3 1033 B12R1.113 CNCc1ccc(cc1)C(=O)N 270004a_106832991635_100000038677 [1,1,0,0,0,0|1,0,0]=3 1034 B12R1.113 CNCc1ccc(cc1)C(=O)N 34a_100102657272_100000231043 [1,1,0,0,0,0|1,0,0]=3 1035 B12R1.113 CNCc1ccc(cc1)C(=O)N 7a_106832991635_100000231043 [1,1,0,0,0,0|1,0,0]=3 1036 B12R1.113 CNCc1ccc(cc1)C(=O)O 269956a_100000181780_200000210301 [1,1,0,0,0,0|0,0,0]=2 1037 B12R1.113 CNCc1ccc(cc1)C(=O)[O-] 26a_100102657272_100016998105 [1,1,0,0,0,0|0,0,1]=3 1038 B12R1.113 CNCc1ccc(cc1)C(C)O 2230a_200000048501_200000210301 [1,1,0,0,0,0|1,0,1]=4 1039 B12R1.113 CNCc1ccc(cc1)C(C)O 26a_100102657272_100000754508 [1,1,0,0,0,0|1,0,1]=4 1040 B12R1.113 CNCc1ccc(cc1)C(C)O 34a_200000048501_200000210301 [1,1,0,0,0,0|1,0,1]=4 1041 B12R1.113 CNCc1ccc(cc1)N(C)C 207a_100102657272_100000185837 [1,1,0,0,0,0|1,0,1]=4 1042 B12R1.113 CNCc1ccc(cc1)N(C)C 270004a_106832991635_100000185837 [1,1,0,0,0,0|1,0,1]=4 1043 B12R1.113 CNCc1ccc(cc1)S(=O)C 26a_100102657272_200000064373 [1,1,0,0,0,0|2,0,0]=4 1044 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 207a_100102657272_100000189386 [1,1,0,0,0,0|1,0,1]=4 1045 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200000210301 [1,1,0,0,0,0|1,0,1]=4 1046 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000181861 [1,1,0,0,0,0|1,0,1]=4 1047 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 26a_100102657272_100000185810 [1,1,0,0,0,0|1,0,1]=4 1048 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 270004a_106832991635_100000189386 [1,1,0,0,0,0|1,0,1]=4 1049 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200000210301 [1,1,0,0,0,0|1,0,1]=4 1050 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100102657272_100000181861 [1,1,0,0,0,0|1,0,1]=4 1051 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000181861 [1,1,0,0,0,0|1,0,1]=4 1052 B12R1.113 CNCc1ccc(nc1)C(=O)O 269956a_100000762669_200000210301 [1,1,0,0,0,0|1,0,0]=3 1053 B12R1.113 COCc1ccc(cc1)C(=O)C 1458a_100000189608_200000210301 [1,1,0,0,0,0|2,0,0]=4 1054 B12R1.113 COCc1ccc(cc1)C(=O)C 34a_100138415774_100000756337 [1,1,0,0,0,0|2,0,0]=4 1055 B12R1.113 COCc1ccc(cc1)C(=O)C 7a_100000082505_200000210301 [1,1,0,0,0,0|2,0,0]=4 1056 B12R1.113 COCc1ccc(cc1)C(=O)N 34a_100000162016_200000210301 [1,1,0,0,0,0|2,0,0]=4 1057 B12R1.113 COCc1ccc(cc1)C(=O)N 34a_100138415774_100000231043 [1,1,0,0,0,0|2,0,0]=4 1058 B12R1.113 COCc1ccc(cc1)C(=O)N 7a_100000162016_200000210301 [1,1,0,0,0,0|2,0,0]=4 1059 B12R1.113 COCc1ccc(cc1)C(=O)[13CH3] 1458a_100000189608_200025704644 [1,1,0,0,0,0|2,0,0]=4 1060 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100000181325_200000210301 [1,1,0,0,0,0|1,0,1]=4 1061 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100138415774_100000181262 [1,1,0,0,0,0|1,0,1]=4 1062 B12R1.113 COCc1ccc(cc1)C(C)C 7a_100000181325_200000210301 [1,1,0,0,0,0|1,0,1]=4 1063 B12R1.113 COCc1ccc(cc1)N(C)C 34a_100000238745_200000210301 [1,1,0,0,0,0|0,0,1]=3 1064 B12R1.113 CSCc1ccc(cc1)C(=O)C 1458a_100000175442_200000210301 [1,1,0,0,0,0|2,0,0]=4 1065 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_100000756337_200000210301 [1,1,0,0,0,0|2,0,0]=4 1066 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_200000210301_100000756337 [1,1,0,0,0,0|2,0,0]=4 1067 B12R1.113 CSCc1ccc(cc1)C(=O)N 62a_100000231043_200000210301 [1,1,0,0,0,0|2,0,0]=4 1068 B12R1.113 CSCc1ccc(cc1)C(=O)N 62a_200000210301_100000231043 [1,1,0,0,0,0|2,0,0]=4 1069 B12R1.113 CSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000175442_200025704644 [1,1,0,0,0,0|2,0,0]=4 1070 B12R1.113 NC(=O)c1ccc(cc1)NCF 34a_100000210537_100015361967 [1,1,0,0,0,0|1,0,0]=3 1071 B12R1.113 NC(=O)c1ccc(cc1)OCF 34a_100000746352_100015361967 [1,1,0,0,0,0|2,0,0]=4 1072 B12R1.113 NC(=O)c1ccc(cc1)OCF 7a_100000746352_100015361967 [1,1,0,0,0,0|2,0,0]=4 1073 B12R1.113 NC(=O)c1ccc(cc1)SCF 62a_100000162191_100015361967 [1,1,0,0,0,0|2,0,0]=4 1074 B12R1.113 NC(=O)c1ccc(cc1)SCF 62a_100015361967_100000162191 [1,1,0,0,0,0|2,0,0]=4 1075 B12R1.113 O=[N+]([O-])c1ccc(cc1)NCF 34a_100015195142_100015361967 [1,1,0,0,0,0|1,0,1]=4 1076 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CCO 1458a_100000078963_200025704644 [1,1,0,0,0,0|2,0,0]=4 1077 B12R1.113 [13CH3]NCc1ccc(cc1)C(=O)O 269956a_100000181780_200025704644 [1,1,0,0,0,0|0,0,0]=2 1078 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200025704644 [1,1,0,0,0,0|1,0,1]=4 1079 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200025704644 [1,1,0,0,0,0|1,0,1]=4 1080 B12R1.113 [13CH3]NCc1ccc(nc1)C(=O)O 269956a_100000762669_200025704644 [1,1,0,0,0,0|1,0,0]=3 1081 B12R1.113 [13CH3]OCc1ccc(cc1)C(=O)N 34a_100000162016_200025704644 [1,1,0,0,0,0|2,0,0]=4 1082 B12R1.113 [13CH3]OCc1ccc(cc1)C(=O)N 7a_100000162016_200025704644 [1,1,0,0,0,0|2,0,0]=4 1083 B12R1.113 [13CH3]SCc1ccc(cc1)C(=O)N 62a_100000231043_200025704644 [1,1,0,0,0,0|2,0,0]=4 1084 B12R1.113 [13CH3]SCc1ccc(cc1)C(=O)N 62a_200025704644_100000231043 [1,1,0,0,0,0|2,0,0]=4 1085 B12R1.452 C=C(C)c1ccc(cc1C)C=O 271570a_100000694244_100000765772 [1,1,0,0,0,0|1,0,1]=4 1086 B12R1.452 C=C(C)c1ccc(cc1C)NC 271570a_100000694244_100102888905 [1,1,0,0,0,0|2,0,0]=4 1087 B12R1.452 C=C(C)c1ccc(cc1F)C=O 271570a_100000694244_100000686674 [1,1,0,0,0,0|1,0,1]=4 1088 B12R1.452 C=C(C)c1ccc(cc1F)NC 271570a_100000694244_100012285320 [1,1,0,0,0,0|2,0,0]=4 1089 B12R1.452 C=C(C)c1ccc(cc1O)C=O 271570a_100000694244_100000041418 [1,1,0,0,0,0|1,0,1]=4 1090 B12R1.452 C=Cc1ccc(c(c1)N)N(C)C 271570a_100011290941_100000737018 [1,1,0,0,0,0|1,0,0]=3 1091 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [1,1,0,0,0,0|2,0,0]=4 1092 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [1,1,0,0,0,0|2,0,0]=4 1093 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [1,1,0,0,0,0|2,0,0]=4 1094 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [1,1,0,0,0,0|2,0,0]=4 1095 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_100012360112_200025704644 [1,1,0,0,0,0|2,0,0]=4 1096 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100012360112 [1,1,0,0,0,0|2,0,0]=4 1097 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [1,1,0,0,0,0|2,0,0]=4 1098 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [1,1,0,0,0,0|2,0,0]=4 1099 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [1,1,0,0,0,0|2,0,0]=4 1100 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [1,1,0,0,0,0|2,0,0]=4 1101 B12R1.452 CC(=O)c1ccc(cc1F)S[13CH3] 62a_100000690205_200025704644 [1,1,0,0,0,0|2,0,0]=4 1102 B12R1.452 CC(=O)c1ccc(cc1N)S[13CH3] 62a_100011590516_200025704644 [1,1,0,0,0,0|2,0,0]=4 1103 B12R1.452 CCc1ccc(c(c1)F)C(=O)C 1458a_200009867912_200000210301 [1,1,0,0,0,0|2,0,0]=4 1104 B12R1.452 CCc1ccc(c(c1)F)C(=O)[13CH3] 1458a_200009867912_200025704644 [1,1,0,0,0,0|2,0,0]=4 1105 B12R1.452 CN(C)c1ccc(cc1Cl)N[13CH3] 34a_100000742791_200025704644 [1,1,0,0,0,0|2,0,0]=4 1106 B12R1.452 CN(C)c1ccc(cc1F)N[13CH3] 34a_100011248830_200025704644 [1,1,0,0,0,0|2,0,0]=4 1107 B12R1.452 CN(C)c1ccc(cc1I)C#N 269982a_200020994358_200000210301 [1,1,0,0,0,0|1,0,1]=4 1108 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_100000737018_200025704644 [1,1,0,0,0,0|2,0,0]=4 1109 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_200025704644_100000737018 [1,1,0,0,0,0|2,0,0]=4 1110 B12R1.452 CN(C)c1ccc(cc1O)C=O 271570a_203496583355_200011298039 [1,1,0,0,0,0|0,0,0]=2 1111 B12R1.452 CN([13CH3])c1ccc(cc1I)C#N 269982a_200020994358_200025704644 [1,1,0,0,0,0|1,0,1]=4 1112 B12R1.452 CNc1cc(c(cn1)C(=O)N)C 27a_100102657272_200134614278 [1,1,0,0,0,0|2,0,0]=4 1113 B12R1.452 CNc1ccc(c(c1)Br)C(=O)N 27a_100102657272_200010146565 [1,1,0,0,0,0|1,0,0]=3 1114 B12R1.452 CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200000210301 [1,1,0,0,0,0|1,0,1]=4 1115 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 27a_100102657272_100011327924 [1,1,0,0,0,0|1,0,0]=3 1116 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 34a_200000751758_200000210301 [1,1,0,0,0,0|1,0,0]=3 1117 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 7a_200000751758_200000210301 [1,1,0,0,0,0|1,0,0]=3 1118 B12R1.452 CNc1ccc(c(c1)C)N(C)C 34a_100000738307_200000210301 [1,1,0,0,0,0|2,0,0]=4 1119 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000745639_200000210301 [1,1,0,0,0,0|1,0,1]=4 1120 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000745639_200000210301 [1,1,0,0,0,0|1,0,1]=4 1121 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200000210301 [1,1,0,0,0,0|1,0,0]=3 1122 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200000210301 [1,1,0,0,0,0|1,0,0]=3 1123 B12R1.452 CNc1ccc(c(c1)Cl)N(C)C 34a_100000742791_200000210301 [1,1,0,0,0,0|2,0,0]=4 1124 B12R1.452 CNc1ccc(c(c1)F)C(=O)C 27a_100102657272_100000690205 [1,1,0,0,0,0|1,0,0]=3 1125 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 27a_100102657272_100000216903 [1,1,0,0,0,0|1,0,0]=3 1126 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 34a_100000749959_200000210301 [1,1,0,0,0,0|1,0,0]=3 1127 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 7a_100000749959_200000210301 [1,1,0,0,0,0|1,0,0]=3 1128 B12R1.452 CNc1ccc(c(c1)F)N(C)C 34a_100011248830_200000210301 [1,1,0,0,0,0|2,0,0]=4 1129 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200000210301 [1,1,0,0,0,0|1,0,1]=4 1130 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200000210301 [1,1,0,0,0,0|1,0,1]=4 1131 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 34a_100000223280_200000210301 [1,1,0,0,0,0|1,0,0]=3 1132 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 7a_100000223280_200000210301 [1,1,0,0,0,0|1,0,0]=3 1133 B12R1.452 CNc1ccc(c(n1)N)C(=O)N 27a_100102657272_100009875182 [1,1,0,0,0,0|2,0,0]=4 1134 B12R1.452 CNc1cnc(c(c1)F)C(=O)N 27a_100102657272_200010161073 [1,1,0,0,0,0|2,0,0]=4 1135 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [1,1,0,0,0,0|2,0,0]=4 1136 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [1,1,0,0,0,0|2,0,0]=4 1137 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [1,1,0,0,0,0|2,0,0]=4 1138 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [1,1,0,0,0,0|2,0,0]=4 1139 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [1,1,0,0,0,0|2,0,0]=4 1140 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [1,1,0,0,0,0|2,0,0]=4 1141 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [1,1,0,0,0,0|2,0,0]=4 1142 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [1,1,0,0,0,0|2,0,0]=4 1143 B12R1.452 COc1ccc(c(c1)C)N(C)C 2230a_103496583619_200000210301 [1,1,0,0,0,0|2,0,0]=4 1144 B12R1.452 COc1ccc(c(c1)C)N(C)C 269982a_103496583619_200000210301 [1,1,0,0,0,0|2,0,0]=4 1145 B12R1.452 COc1ccc(c(c1)C)N(C)C 34a_103496583619_200000210301 [1,1,0,0,0,0|2,0,0]=4 1146 B12R1.452 COc1ccc(c(c1)C)N(C)C 38a_103496583619_200000210301 [1,1,0,0,0,0|2,0,0]=4 1147 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 2230a_103496583619_200025704644 [1,1,0,0,0,0|2,0,0]=4 1148 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 269982a_103496583619_200025704644 [1,1,0,0,0,0|2,0,0]=4 1149 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 34a_103496583619_200025704644 [1,1,0,0,0,0|2,0,0]=4 1150 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 38a_103496583619_200025704644 [1,1,0,0,0,0|2,0,0]=4 1151 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [1,1,0,0,0,0|2,0,0]=4 1152 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [1,1,0,0,0,0|2,0,0]=4 1153 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [1,1,0,0,0,0|2,0,0]=4 1154 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200000210301 [1,1,0,0,0,0|2,0,0]=4 1155 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200000210301 [1,1,0,0,0,0|2,0,0]=4 1156 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [1,1,0,0,0,0|2,0,0]=4 1157 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [1,1,0,0,0,0|2,0,0]=4 1158 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [1,1,0,0,0,0|2,0,0]=4 1159 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [1,1,0,0,0,0|2,0,0]=4 1160 B12R1.452 COc1ccc(c(c1)F)C(=O)N 34a_200012186767_200000210301 [1,1,0,0,0,0|2,0,0]=4 1161 B12R1.452 COc1ccc(c(c1)F)C(=O)N 7a_200012186767_200000210301 [1,1,0,0,0,0|2,0,0]=4 1162 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [1,1,0,0,0,0|2,0,0]=4 1163 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [1,1,0,0,0,0|2,0,0]=4 1164 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [1,1,0,0,0,0|2,0,0]=4 1165 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [1,1,0,0,0,0|2,0,0]=4 1166 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [1,1,0,0,0,0|2,0,0]=4 1167 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [1,1,0,0,0,0|2,0,0]=4 1168 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [1,1,0,0,0,0|2,0,0]=4 1169 B12R1.452 COc1ccc(c(c1)O)C(=O)N 271570a_203496583355_200009815664 [1,1,0,0,0,0|2,0,0]=4 1170 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [1,1,0,0,0,0|2,0,0]=4 1171 B12R1.452 CSc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200000210301 [1,1,0,0,0,0|2,0,0]=4 1172 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 1458a_100012278374_200000210301 [1,1,0,0,0,0|2,0,0]=4 1173 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_100012360112_200000210301 [1,1,0,0,0,0|2,0,0]=4 1174 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_200000210301_100012360112 [1,1,0,0,0,0|2,0,0]=4 1175 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_100011327924_200000210301 [1,1,0,0,0,0|2,0,0]=4 1176 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_200000210301_100011327924 [1,1,0,0,0,0|2,0,0]=4 1177 B12R1.452 CSc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100012278374_200025704644 [1,1,0,0,0,0|2,0,0]=4 1178 B12R1.452 CSc1ccc(c(c1)F)C(=O)C 62a_100000690205_200000210301 [1,1,0,0,0,0|2,0,0]=4 1179 B12R1.452 CSc1ccc(c(c1)F)C(=O)N 62a_100000216903_200000210301 [1,1,0,0,0,0|2,0,0]=4 1180 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_200000210301 [1,1,0,0,0,0|2,0,0]=4 1181 B12R1.452 CSc1ccc(c(c1)N)C(=O)N 62a_100012349972_200000210301 [1,1,0,0,0,0|2,0,0]=4 1182 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_100000737018_200000210301 [1,1,0,0,0,0|2,0,0]=4 1183 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_200000210301_100000737018 [1,1,0,0,0,0|2,0,0]=4 1184 B12R1.452 CSc1ccc(c(c1)O)C(=O)N 62a_100011550861_200000210301 [1,1,0,0,0,0|2,0,0]=4 1185 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 34a_200000751758_200025704644 [1,1,0,0,0,0|1,0,0]=3 1186 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 7a_200000751758_200025704644 [1,1,0,0,0,0|1,0,0]=3 1187 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_100011327924_200025704644 [1,1,0,0,0,0|2,0,0]=4 1188 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_200025704644_100011327924 [1,1,0,0,0,0|2,0,0]=4 1189 B12R1.452 Cc1cc(ccc1N(C)C)N[13CH3] 34a_100000738307_200025704644 [1,1,0,0,0,0|2,0,0]=4 1190 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 34a_100000745639_200025704644 [1,1,0,0,0,0|1,0,1]=4 1191 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 7a_100000745639_200025704644 [1,1,0,0,0,0|1,0,1]=4 1192 B12R1.452 [13CH3]Nc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200025704644 [1,1,0,0,0,0|1,0,1]=4 1193 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200025704644 [1,1,0,0,0,0|1,0,0]=3 1194 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200025704644 [1,1,0,0,0,0|1,0,0]=3 1195 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 34a_100000749959_200025704644 [1,1,0,0,0,0|1,0,0]=3 1196 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 7a_100000749959_200025704644 [1,1,0,0,0,0|1,0,0]=3 1197 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200025704644 [1,1,0,0,0,0|1,0,1]=4 1198 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200025704644 [1,1,0,0,0,0|1,0,1]=4 1199 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 34a_100000223280_200025704644 [1,1,0,0,0,0|1,0,0]=3 1200 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 7a_100000223280_200025704644 [1,1,0,0,0,0|1,0,0]=3 1201 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200025704644 [1,1,0,0,0,0|2,0,0]=4 1202 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200025704644 [1,1,0,0,0,0|2,0,0]=4 1203 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 34a_200012186767_200025704644 [1,1,0,0,0,0|2,0,0]=4 1204 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 7a_200012186767_200025704644 [1,1,0,0,0,0|2,0,0]=4 1205 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [1,1,0,0,0,0|2,0,0]=4 1206 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [1,1,0,0,0,0|2,0,0]=4 1207 B12R1.452 [13CH3]Sc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200025704644 [1,1,0,0,0,0|2,0,0]=4 1208 B12R1.452 [13CH3]Sc1ccc(c(c1)F)C(=O)N 62a_100000216903_200025704644 [1,1,0,0,0,0|2,0,0]=4 1209 B12R1.452 [13CH3]Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_200025704644 [1,1,0,0,0,0|2,0,0]=4 1210 B12R1.452 [13CH3]Sc1ccc(c(c1)O)C(=O)N 62a_100011550861_200025704644 [1,1,0,0,0,0|2,0,0]=4 1211 B12R1.359 CCN(C)c1nc(cs1)C(=O)O 269956a_100000764657_200000210301 [0,1,0,0,1,0|2,0,0]=4 1212 B12R1.359 CCN([13CH3])c1nc(cs1)C(=O)O 269956a_100000764657_200025704644 [0,1,0,0,1,0|2,0,0]=4 1213 B12R1.359 COC(=O)c1cnc(s1)N(C)C 27a_100102631434_100000738003 [0,1,0,0,1,0|2,0,0]=4 1214 B12R1.359 COC(=O)c1coc(n1)N(C)C 27a_100102631434_100010235569 [0,1,0,0,1,0|2,0,0]=4 1215 B14R1.124 C=C(C)c1ccc(c(c1)F)CN(C)C 271570a_100000694244_100000174744 [0,1,0,0,0,1|2,0,0]=4 1216 B14R1.124 CC(=Cc1ccc(cc1Br)C(=O)N)C 271570a_100102525489_100009814583 [0,1,0,0,0,1|2,0,0]=4 1217 B14R1.124 CC(=Cc1ccc(cc1C)C(=O)N)C 271570a_100102525489_100011218126 [0,1,0,0,0,1|2,0,0]=4 1218 B14R1.124 CC(=Cc1ccc(cc1C)N(C)C)C 271570a_100102525489_100011934168 [0,1,0,0,0,1|2,0,0]=4 1219 B14R1.124 CC(=Cc1ccc(cc1F)C(=O)N)C 271570a_100102525489_100000686215 [0,1,0,0,0,1|2,0,0]=4 1220 B14R1.124 CC(=Cc1ccc(cc1O)C(=O)N)C 271570a_100102525489_100012344895 [0,1,0,0,0,1|2,0,0]=4 1221 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 11a_100011218581_100015343762 [0,1,0,0,0,1|2,0,0]=4 1222 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 1626a_100011218581_100015343762 [0,1,0,0,0,1|2,0,0]=4 1223 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 527a_100011218581_100103153847 [0,1,0,0,0,1|2,0,0]=4 1224 B14R1.124 CC(=O)Nc1ccc(cc1Br)N(C)C 11a_200013039233_100015343762 [0,1,0,0,0,1|1,0,0]=3 1225 B14R1.124 CC(=O)Nc1ccc(cc1Br)N(C)C 1626a_200013039233_100015343762 [0,1,0,0,0,1|1,0,0]=3 1226 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 11a_100000246174_100015343762 [0,1,0,0,0,1|1,0,0]=3 1227 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 1626a_100000246174_100015343762 [0,1,0,0,0,1|1,0,0]=3 1228 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 22a_100000246174_100000070787 [0,1,0,0,0,1|1,0,0]=3 1229 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 527a_100000246174_100103153847 [0,1,0,0,0,1|1,0,0]=3 1230 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 11a_100012355998_100015343762 [0,1,0,0,0,1|2,0,0]=4 1231 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 1626a_100012355998_100015343762 [0,1,0,0,0,1|2,0,0]=4 1232 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 22a_100012355998_100000070787 [0,1,0,0,0,1|2,0,0]=4 1233 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 527a_100012355998_100103153847 [0,1,0,0,0,1|2,0,0]=4 1234 B14R1.124 CC(=O)Nc1ccc(cc1O)C(C)C 271570a_203496583355_200009992923 [0,1,0,0,0,1|2,0,0]=4 1235 B14R1.124 CC(=O)c1ccc(c(c1)Br)C=C(C)C 271570a_100102525489_100010146554 [0,1,0,0,0,1|2,0,0]=4 1236 B14R1.124 CC(=O)c1ccc(c(c1)Br)CN(C)C 2230a_100102631434_100010884425 [0,1,0,0,0,1|1,0,0]=3 1237 B14R1.124 CC(=O)c1ccc(c(c1)Br)CN(C)C 269982a_100102631434_100010884425 [0,1,0,0,0,1|1,0,0]=3 1238 B14R1.124 CC(=O)c1ccc(c(c1)Br)OC(C)C 1458a_100000243735_200000210301 [0,1,0,0,0,1|2,0,0]=4 1239 B14R1.124 CC(=O)c1ccc(c(c1)Br)OC(C)C 34a_100011772453_100000210206 [0,1,0,0,0,1|2,0,0]=4 1240 B14R1.124 CC(=O)c1ccc(c(c1)Br)OC(C)C 7a_100011772453_100000210206 [0,1,0,0,0,1|2,0,0]=4 1241 B14R1.124 CC(=O)c1ccc(c(c1)Br)SC(C)C 62a_100000210206_100010146554 [0,1,0,0,0,1|2,0,0]=4 1242 B14R1.124 CC(=O)c1ccc(c(c1)Br)SC(C)C 62a_100010146554_100000210206 [0,1,0,0,0,1|2,0,0]=4 1243 B14R1.124 CC(=O)c1ccc(c(c1)C)C=C(C)C 271570a_100102525489_100000697869 [0,1,0,0,0,1|2,0,0]=4 1244 B14R1.124 CC(=O)c1ccc(c(c1)C)OC(C)C 1458a_200011734124_200000210301 [0,1,0,0,0,1|2,0,0]=4 1245 B14R1.124 CC(=O)c1ccc(c(c1)C)OC(C)C 34a_100000188726_100000210206 [0,1,0,0,0,1|2,0,0]=4 1246 B14R1.124 CC(=O)c1ccc(c(c1)C)OC(C)C 7a_100000188726_100000210206 [0,1,0,0,0,1|2,0,0]=4 1247 B14R1.124 CC(=O)c1ccc(c(c1)C)SC(C)C 62a_100000210206_100000697869 [0,1,0,0,0,1|2,0,0]=4 1248 B14R1.124 CC(=O)c1ccc(c(c1)C)SC(C)C 62a_100000697869_100000210206 [0,1,0,0,0,1|2,0,0]=4 1249 B14R1.124 CC(=O)c1ccc(c(c1)Cl)OC(C)C 1458a_100011453123_200000210301 [0,1,0,0,0,1|2,0,0]=4 1250 B14R1.124 CC(=O)c1ccc(c(c1)Cl)OC(C)C 34a_100000188625_100000210206 [0,1,0,0,0,1|2,0,0]=4 1251 B14R1.124 CC(=O)c1ccc(c(c1)Cl)OC(C)C 7a_100000188625_100000210206 [0,1,0,0,0,1|2,0,0]=4 1252 B14R1.124 CC(=O)c1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100000690002 [0,1,0,0,0,1|2,0,0]=4 1253 B14R1.124 CC(=O)c1ccc(c(c1)F)OC(C)C 1458a_200011234205_200000210301 [0,1,0,0,0,1|2,0,0]=4 1254 B14R1.124 CC(=O)c1ccc(c(c1)F)OC(C)C 34a_100000751691_100000210206 [0,1,0,0,0,1|2,0,0]=4 1255 B14R1.124 CC(=O)c1ccc(c(c1)F)OC(C)C 7a_100000751691_100000210206 [0,1,0,0,0,1|2,0,0]=4 1256 B14R1.124 CC(=O)c1ccc(c(c1)F)SC(C)C 62a_100000210206_100000690002 [0,1,0,0,0,1|2,0,0]=4 1257 B14R1.124 CC(=O)c1ccc(c(c1)F)SC(C)C 62a_100000690002_100000210206 [0,1,0,0,0,1|2,0,0]=4 1258 B14R1.124 CC(=O)c1ccc(c(c1)I)OC(C)C 1458a_100012355715_200000210301 [0,1,0,0,0,1|2,0,0]=4 1259 B14R1.124 CC(=O)c1ccc(c(c1)N)C=C(C)C 271570a_100102525489_100009816534 [0,1,0,0,0,1|2,0,0]=4 1260 B14R1.124 CC(=O)c1ccc(c(c1)N)OC(C)C 34a_100000117292_100000210206 [0,1,0,0,0,1|2,0,0]=4 1261 B14R1.124 CC(=O)c1ccc(c(c1)N)OC(C)C 7a_100000117292_100000210206 [0,1,0,0,0,1|2,0,0]=4 1262 B14R1.124 CC(=O)c1ccc(c(c1)N)SC(C)C 62a_100009816534_100000210206 [0,1,0,0,0,1|2,0,0]=4 1263 B14R1.124 CC(C)Nc1ccc(cc1Br)C(=O)N 27a_100138425928_100009814583 [0,1,0,0,0,1|2,0,0]=4 1264 B14R1.124 CC(C)Nc1ccc(cc1F)C(=O)N 27a_100138425928_100000686215 [0,1,0,0,0,1|2,0,0]=4 1265 B14R1.124 CC(C)Oc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000243735_200025704644 [0,1,0,0,0,1|2,0,0]=4 1266 B14R1.124 CC(C)Oc1ccc(cc1Cl)C(=O)N 34a_200000192832_100000210206 [0,1,0,0,0,1|2,0,0]=4 1267 B14R1.124 CC(C)Oc1ccc(cc1Cl)C(=O)N 7a_200000192832_100000210206 [0,1,0,0,0,1|2,0,0]=4 1268 B14R1.124 CC(C)Oc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100011453123_200025704644 [0,1,0,0,0,1|2,0,0]=4 1269 B14R1.124 CC(C)Oc1ccc(cc1F)C(=O)[13CH3] 1458a_200011234205_200025704644 [0,1,0,0,0,1|2,0,0]=4 1270 B14R1.124 CC(C)Oc1ccc(cc1I)C(=O)[13CH3] 1458a_100012355715_200025704644 [0,1,0,0,0,1|2,0,0]=4 1271 B14R1.124 CC(C)Sc1ccc(cc1Br)C(=O)N 62a_100000210206_100009814583 [0,1,0,0,0,1|2,0,0]=4 1272 B14R1.124 CC(C)Sc1ccc(cc1Br)C(=O)N 62a_100009814583_100000210206 [0,1,0,0,0,1|2,0,0]=4 1273 B14R1.124 CC(C)Sc1ccc(cc1F)C(=O)N 62a_100000210206_100000686215 [0,1,0,0,0,1|2,0,0]=4 1274 B14R1.124 CC(C)Sc1ccc(cc1F)C(=O)N 62a_100000686215_100000210206 [0,1,0,0,0,1|2,0,0]=4 1275 B14R1.124 CC(C)Sc1ccc(cc1O)C(=O)N 62a_100000210206_100012344895 [0,1,0,0,0,1|2,0,0]=4 1276 B14R1.124 CC(C)Sc1ccc(cc1O)C(=O)N 62a_100012344895_100000210206 [0,1,0,0,0,1|2,0,0]=4 1277 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 2230a_100102631434_100000741879 [0,1,0,0,0,1|1,0,1]=4 1278 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 269982a_100102631434_100000741879 [0,1,0,0,0,1|1,0,1]=4 1279 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 270004a_100102631434_100011202981 [0,1,0,0,0,1|1,0,1]=4 1280 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 2230a_100102631434_100000747184 [0,1,0,0,0,1|1,0,1]=4 1281 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 269982a_100102631434_100000747184 [0,1,0,0,0,1|1,0,1]=4 1282 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 270004a_100102631434_100000755334 [0,1,0,0,0,1|1,0,1]=4 1283 B14R1.124 CN(C)Cc1ccc(cc1F)[N+](=O)[O-] 2230a_100102631434_100000759423 [0,1,0,0,0,1|1,0,1]=4 1284 B14R1.124 CN(C)Cc1ccc(cc1F)[N+](=O)[O-] 269982a_100102631434_100000759423 [0,1,0,0,0,1|1,0,1]=4 1285 B14R1.124 Cc1cc(ccc1CN(C)C)[N+](=O)[O-] 2230a_100102631434_100010218038 [0,1,0,0,0,1|1,0,1]=4 1286 B14R1.124 Cc1cc(ccc1CN(C)C)[N+](=O)[O-] 269982a_100102631434_100010218038 [0,1,0,0,0,1|1,0,1]=4 1287 B14R1.124 Cc1cc(ccc1NC(C)C)C(=O)N 27a_100138425928_100011218126 [0,1,0,0,0,1|2,0,0]=4 1288 B14R1.124 Cc1cc(ccc1NC(C)C)C(=O)N 34a_100000746439_100000210206 [0,1,0,0,0,1|2,0,0]=4 1289 B14R1.124 Cc1cc(ccc1NC(C)C)C(=O)N 7a_100000746439_100000210206 [0,1,0,0,0,1|2,0,0]=4 1290 B14R1.124 Cc1cc(ccc1OC(C)C)C(=O)[13CH3] 1458a_200011734124_200025704644 [0,1,0,0,0,1|2,0,0]=4 1291 B14R1.124 Cc1cc(ccc1SC(C)C)C(=O)N 62a_100000210206_100011218126 [0,1,0,0,0,1|2,0,0]=4 1292 B14R1.124 Cc1cc(ccc1SC(C)C)C(=O)N 62a_100011218126_100000210206 [0,1,0,0,0,1|2,0,0]=4 1293 B14R1.414 CC(=O)c1ccc(cc1)OC(C)(C)C 1458a_100000766517_200000210301 [0,1,0,0,0,1|2,0,0]=4 1294 B14R1.414 CC(=O)c1ccc(cc1)OC(C)(C)C 34a_100000185113_100000210625 [0,1,0,0,0,1|2,0,0]=4 1295 B14R1.414 CC(=O)c1ccc(cc1)SC(C)(C)C 62a_100000185465_100000211941 [0,1,0,0,0,1|2,0,0]=4 1296 B14R1.414 CC(=O)c1ccc(cc1)SC(C)(C)C 62a_100000211941_100000185465 [0,1,0,0,0,1|2,0,0]=4 1297 B14R1.414 CC(C)(C)Nc1ccc(cc1)C(=O)N 34a_100000210537_100000210625 [0,1,0,0,0,1|2,0,0]=4 1298 B14R1.414 CC(C)(C)Oc1ccc(cc1)C(=O)N 34a_100000746352_100000210625 [0,1,0,0,0,1|2,0,0]=4 1299 B14R1.414 CC(C)(C)Oc1ccc(cc1)C(=O)[13CH3] 1458a_100000766517_200025704644 [0,1,0,0,0,1|2,0,0]=4 1300 B14R1.414 CC(C)(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_100000211941 [0,1,0,0,0,1|2,0,0]=4 1301 B14R1.414 CC(C)(C)Sc1ccc(cc1)C(=O)N 62a_100000211941_100000162191 [0,1,0,0,0,1|2,0,0]=4 1302 B14R1.414 CN(C)c1ccc(cc1)NS(=O)(=O)C 40a_100016997997_100000738038 [0,1,0,0,0,1|1,0,1]=4 1303 B14R1.717 CC(=Cc1ccc(cc1)C(=O)C#N)C 271570a_100102525489_100009994572 [0,1,0,0,0,1|2,0,0]=4 1304 B14R1.717 CC(=Cc1ccc(cc1)C(=O)C=O)C 271570a_100102525489_100000725942 [0,1,0,0,0,1|1,0,1]=4 1305 B14R1.717 CC(=Cc1ccc(cc1)C(=O)CN)C 271570a_100102525489_100000017248 [0,1,0,0,0,1|2,0,0]=4 1306 B14R1.717 CC(=Cc1ccc(cc1)C(=O)CO)C 271570a_100102525489_100011219529 [0,1,0,0,0,1|1,0,0]=3 1307 B14R1.717 CC(=Cc1ccc(cc1)C(=O)NN)C 271570a_100102525489_100000183614 [0,1,0,0,0,1|2,0,0]=4 1308 B14R1.717 CC(=NO)c1ccc(cc1)OC(C)C 34a_100000164205_100000210206 [0,1,0,0,0,1|2,0,0]=4 1309 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 269982a_100000219403_100015361967 [0,1,0,0,0,1|1,0,0]=3 1310 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 34a_100000219403_100015361967 [0,1,0,0,0,1|1,0,0]=3 1311 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 38a_100000219403_100015361967 [0,1,0,0,0,1|1,0,0]=3 1312 B14R1.717 CC(C)Cc1ccc(cc1)C(=O)CF 1458a_100000185289_100015361967 [0,1,0,0,0,1|2,0,0]=4 1313 B14R1.717 CC(C)Nc1ccc(cc1)C(=O)NN 27a_100138425928_100000183614 [0,1,0,0,0,1|2,0,0]=4 1314 B14R1.717 CC(C)Oc1ccc(cc1)C(=NO)N 34a_100000231063_100000210206 [0,1,0,0,0,1|2,0,0]=4 1315 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210206 [0,1,0,0,0,1|2,0,0]=4 1316 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210206 [0,1,0,0,0,1|2,0,0]=4 1317 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)CF 1458a_100000182917_100015361967 [0,1,0,0,0,1|2,0,0]=4 1318 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)CF 34a_200010654591_100000210206 [0,1,0,0,0,1|2,0,0]=4 1319 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)CF 7a_200010654591_100000210206 [0,1,0,0,0,1|2,0,0]=4 1320 B14R1.717 CC(C)Oc1ccc(cc1)C(=O)NN 34a_100000185078_100000210206 [0,1,0,0,0,1|2,0,0]=4 1321 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)C#N 62a_100000210206_100009994572 [0,1,0,0,0,1|2,0,0]=4 1322 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000210206_100000725942 [0,1,0,0,0,1|1,0,1]=4 1323 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210206 [0,1,0,0,0,1|1,0,1]=4 1324 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)CF 1458a_100000244970_100015361967 [0,1,0,0,0,1|2,0,0]=4 1325 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)CN 62a_100000017248_100000210206 [0,1,0,0,0,1|2,0,0]=4 1326 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)CN 62a_100000210206_100000017248 [0,1,0,0,0,1|2,0,0]=4 1327 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)CO 62a_100000210206_100011219529 [0,1,0,0,0,1|1,0,0]=3 1328 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)CO 62a_100011219529_100000210206 [0,1,0,0,0,1|1,0,0]=3 1329 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)NN 62a_100000183614_100000210206 [0,1,0,0,0,1|2,0,0]=4 1330 B14R1.717 CC(C)Sc1ccc(cc1)C(=O)NN 62a_100000210206_100000183614 [0,1,0,0,0,1|2,0,0]=4 1331 B14R1.717 CCC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000211647 [0,1,0,0,0,1|2,0,0]=4 1332 B14R1.717 CCC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_100000210202 [0,1,0,0,0,1|2,0,0]=4 1333 B14R1.717 CCC(=O)c1ccc(cc1)CN(C)C 1458a_100000749272_100000210202 [0,1,0,0,0,1|1,0,0]=3 1334 B14R1.717 CCC(=O)c1ccc(cc1)OC(C)C 1458a_100000182917_100000210202 [0,1,0,0,0,1|2,0,0]=4 1335 B14R1.717 CCC(=O)c1ccc(cc1)OC(C)C 34a_100000212119_100000210206 [0,1,0,0,0,1|2,0,0]=4 1336 B14R1.717 CCC(=O)c1ccc(cc1)OC(C)C 7a_100000212119_100000210206 [0,1,0,0,0,1|2,0,0]=4 1337 B14R1.717 CCC(=O)c1ccc(cc1)SC(C)C 1458a_100000244970_100000210202 [0,1,0,0,0,1|2,0,0]=4 1338 B14R1.717 CCC(=O)c1ccc(cc1)SC(C)C 62a_100000210206_100000211647 [0,1,0,0,0,1|2,0,0]=4 1339 B14R1.717 CCC(=O)c1ccc(cc1)SC(C)C 62a_100000211647_100000210206 [0,1,0,0,0,1|2,0,0]=4 1340 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 11a_100000211316_100015343762 [0,1,0,0,0,1|2,0,0]=4 1341 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 1626a_100000211316_100015343762 [0,1,0,0,0,1|2,0,0]=4 1342 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 22a_100000211316_100000070787 [0,1,0,0,0,1|2,0,0]=4 1343 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 527a_100000211316_100103153847 [0,1,0,0,0,1|2,0,0]=4 1344 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000210202 [0,1,0,0,0,1|1,0,0]=3 1345 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000204670 [0,1,0,0,0,1|1,0,0]=3 1346 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000210202 [0,1,0,0,0,1|1,0,0]=3 1347 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000204670 [0,1,0,0,0,1|1,0,0]=3 1348 B14R1.717 CN(C)Cc1ccc(cc1)C(=O)CF 1458a_100000749272_100015361967 [0,1,0,0,0,1|1,0,0]=3 1349 B14R1.717 CNC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000155074 [0,1,0,0,0,1|2,0,0]=4 1350 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 11a_106832991635_100000185289 [0,1,0,0,0,1|2,0,0]=4 1351 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 1626a_100102657272_100000185289 [0,1,0,0,0,1|2,0,0]=4 1352 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 240690a_100102657272_100000185289 [0,1,0,0,0,1|2,0,0]=4 1353 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 527a_100102657272_100000185289 [0,1,0,0,0,1|2,0,0]=4 1354 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 11a_106832991635_100000749272 [0,1,0,0,0,1|1,0,0]=3 1355 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 1626a_100102657272_100000749272 [0,1,0,0,0,1|1,0,0]=3 1356 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000753832 [0,1,0,0,0,1|1,0,0]=3 1357 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 240690a_100102657272_100000749272 [0,1,0,0,0,1|1,0,0]=3 1358 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000753832 [0,1,0,0,0,1|1,0,0]=3 1359 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 270004a_100102631434_100000043907 [0,1,0,0,0,1|1,0,0]=3 1360 B14R1.717 CNC(=O)c1ccc(cc1)CN(C)C 527a_100102657272_100000749272 [0,1,0,0,0,1|1,0,0]=3 1361 B14R1.717 CNC(=O)c1ccc(cc1)NC(C)C 2230a_100000184841_100000210206 [0,1,0,0,0,1|2,0,0]=4 1362 B14R1.717 CNC(=O)c1ccc(cc1)NC(C)C 27a_100138425928_100000155074 [0,1,0,0,0,1|2,0,0]=4 1363 B14R1.717 CNC(=O)c1ccc(cc1)NC(C)C 34a_100000184841_100000210206 [0,1,0,0,0,1|2,0,0]=4 1364 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 11a_106832991635_100000182917 [0,1,0,0,0,1|2,0,0]=4 1365 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 1626a_100102657272_100000182917 [0,1,0,0,0,1|2,0,0]=4 1366 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 240690a_100102657272_100000182917 [0,1,0,0,0,1|2,0,0]=4 1367 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 34a_100000192141_100000210206 [0,1,0,0,0,1|2,0,0]=4 1368 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 527a_100102657272_100000182917 [0,1,0,0,0,1|2,0,0]=4 1369 B14R1.717 CNC(=O)c1ccc(cc1)OC(C)C 7a_100000192141_100000210206 [0,1,0,0,0,1|2,0,0]=4 1370 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 11a_106832991635_100000244970 [0,1,0,0,0,1|2,0,0]=4 1371 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 1626a_100102657272_100000244970 [0,1,0,0,0,1|2,0,0]=4 1372 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 240690a_100102657272_100000244970 [0,1,0,0,0,1|2,0,0]=4 1373 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 527a_100102657272_100000244970 [0,1,0,0,0,1|2,0,0]=4 1374 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 62a_100000155074_100000210206 [0,1,0,0,0,1|2,0,0]=4 1375 B14R1.717 CNC(=O)c1ccc(cc1)SC(C)C 62a_100000210206_100000155074 [0,1,0,0,0,1|2,0,0]=4 1376 B14R1.717 CNC(C)c1ccc(cc1)NC(=O)C 269862a_106832991636_100000152756 [0,1,0,0,0,1|2,0,0]=4 1377 B14R1.717 CNC(C)c1ccc(cc1)OC(=O)C 269862a_106832991636_100000001828 [0,1,0,0,0,1|2,0,0]=4 1378 B14R1.717 COC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000150774 [0,1,0,0,0,1|1,0,0]=3 1379 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000735637 [0,1,0,0,0,1|2,0,0]=4 1380 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100012277402_200000210301 [0,1,0,0,0,1|2,0,0]=4 1381 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100012277402_200025704644 [0,1,0,0,0,1|2,0,0]=4 1382 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100000737656_200000210301 [0,1,0,0,0,1|0,0,0]=2 1383 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000735637 [0,1,0,0,0,1|0,0,0]=2 1384 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100000737656_200000210301 [0,1,0,0,0,1|0,0,0]=2 1385 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000735637 [0,1,0,0,0,1|0,0,0]=2 1386 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 270004a_100102631434_100000148700 [0,1,0,0,0,1|0,0,0]=2 1387 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 2230a_100000737656_200025704644 [0,1,0,0,0,1|0,0,0]=2 1388 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 269982a_100000737656_200025704644 [0,1,0,0,0,1|0,0,0]=2 1389 B14R1.717 COC(=O)c1ccc(cc1)NC(=O)C 188690a_100016994500_100015343762 [0,1,0,0,0,1|2,0,0]=4 1390 B14R1.717 COC(=O)c1ccc(cc1)OC(C)C 34a_100000150123_100000210206 [0,1,0,0,0,1|1,0,0]=3 1391 B14R1.717 COC(=O)c1ccc(cc1)OC(C)C 7a_100000150123_100000210206 [0,1,0,0,0,1|1,0,0]=3 1392 B14R1.717 COC(=O)c1ccc(cc1)SC(C)C 62a_100000150774_100000210206 [0,1,0,0,0,1|1,0,0]=3 1393 B14R1.717 COC(=O)c1ccc(cc1)SC(C)C 62a_100000210206_100000150774 [0,1,0,0,0,1|1,0,0]=3 1394 B14R1.717 COC(=O)c1ccc(cn1)C=C(C)C 271570a_100102525489_100000690920 [0,1,0,0,0,1|2,0,0]=4 1395 B14R1.717 COC(=O)c1ccc(cn1)CN(C)C 2230a_100102631434_100010177729 [0,1,0,0,0,1|1,0,0]=3 1396 B14R1.717 COC(=O)c1ccc(cn1)CN(C)C 269982a_100102631434_100010177729 [0,1,0,0,0,1|1,0,0]=3 1397 B14R1.717 COC(=O)c1ccc(cn1)CN(C)C 270004a_100102631434_102516457225 [0,1,0,0,0,1|1,0,0]=3 1398 B14R1.717 COC(=O)c1ccc(cn1)OC(C)C 34a_100011997255_100000210206 [0,1,0,0,0,1|2,0,0]=4 1399 B14R1.717 COC(=O)c1ccc(cn1)OC(C)C 7a_100011997255_100000210206 [0,1,0,0,0,1|2,0,0]=4 1400 B14R1.717 COC(=O)c1ccc(cn1)SC(C)C 62a_100000210206_100102712061 [0,1,0,0,0,1|2,0,0]=4 1401 B14R1.717 COC(=O)c1ccc(cn1)SC(C)C 62a_100102712061_100000210206 [0,1,0,0,0,1|2,0,0]=4 1402 B14R1.717 COC(=O)c1ccc(nc1)C=C(C)C 271570a_100102525489_100000733799 [0,1,0,0,0,1|2,0,0]=4 1403 B14R1.717 COC(=O)c1ccc(nc1)CN(C)C 2230a_100102631434_100000063545 [0,1,0,0,0,1|1,0,0]=3 1404 B14R1.717 COC(=O)c1ccc(nc1)CN(C)C 269982a_100102631434_100000063545 [0,1,0,0,0,1|1,0,0]=3 1405 B14R1.717 COC(=O)c1ccc(nc1)CN(C)C 270004a_100102631434_100000762506 [0,1,0,0,0,1|1,0,0]=3 1406 B14R1.717 COC(=O)c1ccc(nc1)NC(C)C 27a_100138425928_100000733799 [0,1,0,0,0,1|2,0,0]=4 1407 B14R1.717 COC(=O)c1ccc(nc1)SC(C)C 62a_100000210206_100000733799 [0,1,0,0,0,1|2,0,0]=4 1408 B14R1.717 COC(=O)c1ccc(nc1)SC(C)C 62a_100000733799_100000210206 [0,1,0,0,0,1|2,0,0]=4 1409 B14R1.717 COC(=O)c1cnc(cn1)CN(C)C 2230a_100102631434_200010203303 [0,1,0,0,0,1|2,0,0]=4 1410 B14R1.717 COC(=O)c1cnc(cn1)CN(C)C 270004a_100102631434_100009852676 [0,1,0,0,0,1|2,0,0]=4 1411 B14R1.806 CC(=O)Cc1ccc(cc1)C(C)(C)C 1458a_100000070787_100000212263 [0,1,0,0,0,1|2,0,0]=4 1412 B14R1.806 CC(=O)Cc1ccc(cc1)C(C)(C)C 1458a_100000186723_200000210301 [0,1,0,0,0,1|2,0,0]=4 1413 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 11a_100000210346_100015343762 [0,1,0,0,0,1|2,0,0]=4 1414 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 1626a_100000210346_100015343762 [0,1,0,0,0,1|2,0,0]=4 1415 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 22a_100000210346_100000070787 [0,1,0,0,0,1|2,0,0]=4 1416 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 527a_100000210346_100103153847 [0,1,0,0,0,1|2,0,0]=4 1417 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 11a_100009954384_100015343762 [0,1,0,0,0,1|2,0,0]=4 1418 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 1626a_100009954384_100015343762 [0,1,0,0,0,1|2,0,0]=4 1419 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 22a_100009954384_100000070787 [0,1,0,0,0,1|2,0,0]=4 1420 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 527a_100009954384_100103153847 [0,1,0,0,0,1|2,0,0]=4 1421 B14R1.806 CC(C)(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000186723_200025704644 [0,1,0,0,0,1|2,0,0]=4 1422 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)C 2230a_100102631434_100000717844 [0,1,0,0,0,1|1,0,1]=4 1423 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)C 269982a_100102631434_100000717844 [0,1,0,0,0,1|1,0,1]=4 1424 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)C 270004a_100102631434_100000743486 [0,1,0,0,0,1|1,0,1]=4 1425 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)N 2230a_100102631434_200012292325 [0,1,0,0,0,1|1,0,1]=4 1426 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)N 269982a_100102631434_200012292325 [0,1,0,0,0,1|1,0,1]=4 1427 B14R1.806 CN(C)Cc1ccc(cc1)S(=O)(=O)N 270004a_100102631434_100000080001 [0,1,0,0,0,1|1,0,1]=4 1428 B14R1.2879 C#CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000211873_100000181262 [0,1,0,0,0,1|2,0,0]=4 1429 B14R1.2879 C=C(C)c1ccc(cc1)CC(=O)OC 271570a_100000694244_100000149743 [0,1,0,0,0,1|1,0,1]=4 1430 B14R1.2879 C=C(C)c1ccc(cc1)CN(C)CC 26a_100000225621_100009880102 [0,1,0,0,0,1|2,0,0]=4 1431 B14R1.2879 C=C(C)c1ccc(cc1)NC(=O)OC 271570a_100000694244_100000181880 [0,1,0,0,0,1|1,0,1]=4 1432 B14R1.2879 C=CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000185746_100000181262 [0,1,0,0,0,1|2,0,0]=4 1433 B14R1.2879 C=CC(=O)Nc1ccc(cc1)C(C)C 1626a_100000210773_100000185746 [0,1,0,0,0,1|2,0,0]=4 1434 B14R1.2879 C=CC(=O)Nc1ccc(cc1)C(C)C 22a_100000210773_100000185746 [0,1,0,0,0,1|2,0,0]=4 1435 B14R1.2879 C=CC(=O)Nc1ccc(cc1)N(C)C 1626a_100016997997_100000185746 [0,1,0,0,0,1|1,0,0]=3 1436 B14R1.2879 C=CC(=O)Nc1ccc(cc1)N(C)C 22a_100016997997_100000185746 [0,1,0,0,0,1|1,0,0]=3 1437 B14R1.2879 CC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000756337 [0,1,0,0,0,1|2,0,0]=4 1438 B14R1.2879 CC(=O)c1ccc(cc1)OC(C)CO 34a_100000185113_100012180447 [0,1,0,0,0,1|2,0,0]=4 1439 B14R1.2879 CC(=O)c1ccc(cc1)OC(C)CO 7a_100000185113_100012180447 [0,1,0,0,0,1|2,0,0]=4 1440 B14R1.2879 CC(=O)c1ccc(cc1)SC(C)CO 62a_100012180447_100000185465 [0,1,0,0,0,1|2,0,0]=4 1441 B14R1.2879 CC(=O)c1ccc(cc1)S[C@H](C)CO 62a_100000185465_100016084084 [0,1,0,0,0,1|2,0,0]=4 1442 B14R1.2879 CC(=O)c1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000185465 [0,1,0,0,0,1|2,0,0]=4 1443 B14R1.2879 CC(C)c1ccc(cc1)CC(=O)CF 1458a_100000689720_100015361967 [0,1,0,0,0,1|2,0,0]=4 1444 B14R1.2879 CC(C)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181262 [0,1,0,0,0,1|1,0,0]=3 1445 B14R1.2879 CC(C)c1ccc(cc1)NC(=O)CO 22a_100000210773_100000210174 [0,1,0,0,0,1|1,0,0]=3 1446 B14R1.2879 CC(C)c1ccc(cc1)NC(=O)CO 527a_100000210773_100000210174 [0,1,0,0,0,1|1,0,0]=3 1447 B14R1.2879 CC(CO)Nc1ccc(cc1)C(=O)N 34a_100000210537_100012180447 [0,1,0,0,0,1|2,0,0]=4 1448 B14R1.2879 CC(CO)Nc1ccc(cc1)N(C)C 34a_100016997997_100012180447 [0,1,0,0,0,1|1,0,1]=4 1449 B14R1.2879 CC(CO)Oc1ccc(cc1)C(=O)N 34a_100000746352_100012180447 [0,1,0,0,0,1|2,0,0]=4 1450 B14R1.2879 CC(CO)Oc1ccc(cc1)C(=O)N 7a_100000746352_100012180447 [0,1,0,0,0,1|2,0,0]=4 1451 B14R1.2879 CC(CO)Oc1ccc(cc1)N(C)C 34a_100000718910_100012180447 [0,1,0,0,0,1|1,0,1]=4 1452 B14R1.2879 CC(CO)Sc1ccc(cc1)C(=O)N 62a_100012180447_100000162191 [0,1,0,0,0,1|2,0,0]=4 1453 B14R1.2879 CC(CO)Sc1ccc(cc1)N(C)C 62a_100012180447_100000210421 [0,1,0,0,0,1|1,0,1]=4 1454 B14R1.2879 CC(O)c1ccc(cc1)NC(=O)CO 22a_100011216399_100000210174 [0,1,0,0,0,1|2,0,0]=4 1455 B14R1.2879 CC(O)c1ccc(cc1)NC(=O)CO 527a_100011216399_100000210174 [0,1,0,0,0,1|2,0,0]=4 1456 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(C)C 1458a_100000210414_100000181262 [0,1,0,0,0,1|2,0,0]=4 1457 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_100000210202 [0,1,0,0,0,1|2,0,0]=4 1458 B14R1.2879 CCC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_100000210202 [0,1,0,0,0,1|1,0,0]=3 1459 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 11a_100000210773_100000210414 [0,1,0,0,0,1|2,0,0]=4 1460 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 1626a_100000210773_100000210414 [0,1,0,0,0,1|2,0,0]=4 1461 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 22a_100000210773_100000210414 [0,1,0,0,0,1|2,0,0]=4 1462 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 527a_100000210773_100000210414 [0,1,0,0,0,1|2,0,0]=4 1463 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 11a_100016997997_100000210414 [0,1,0,0,0,1|1,0,0]=3 1464 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 1626a_100016997997_100000210414 [0,1,0,0,0,1|1,0,0]=3 1465 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 22a_100016997997_100000210414 [0,1,0,0,0,1|1,0,0]=3 1466 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 527a_100016997997_100000210414 [0,1,0,0,0,1|1,0,0]=3 1467 B14R1.2879 CCC(C)Nc1ccc(cc1)C(=O)N 34a_100000210537_100011215416 [0,1,0,0,0,1|2,0,0]=4 1468 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)C 1458a_200000188679_200000210301 [0,1,0,0,0,1|2,0,0]=4 1469 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)C 34a_100000185113_100011215416 [0,1,0,0,0,1|2,0,0]=4 1470 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)C 7a_100000185113_100000758301 [0,1,0,0,0,1|2,0,0]=4 1471 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)N 34a_100000746352_100011215416 [0,1,0,0,0,1|2,0,0]=4 1472 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)N 7a_100000746352_100000758301 [0,1,0,0,0,1|2,0,0]=4 1473 B14R1.2879 CCC(C)Oc1ccc(cc1)C(=O)[13CH3] 1458a_200000188679_200025704644 [0,1,0,0,0,1|2,0,0]=4 1474 B14R1.2879 CCC(C)Sc1ccc(cc1)C(=O)C 62a_100000185465_100000758301 [0,1,0,0,0,1|2,0,0]=4 1475 B14R1.2879 CCC(C)Sc1ccc(cc1)C(=O)C 62a_100000758301_100000185465 [0,1,0,0,0,1|2,0,0]=4 1476 B14R1.2879 CCC(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_100000758301 [0,1,0,0,0,1|2,0,0]=4 1477 B14R1.2879 CCC(C)Sc1ccc(cc1)C(=O)N 62a_100000758301_100000162191 [0,1,0,0,0,1|2,0,0]=4 1478 B14R1.2879 CCN(C)Cc1ccc(cc1)B(O)O 2230a_100000225621_100009813762 [0,1,0,0,0,1|1,0,1]=4 1479 B14R1.2879 CCN(C)Cc1ccc(cc1)B(O)O 269982a_100000225621_100009813762 [0,1,0,0,0,1|1,0,1]=4 1480 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)C 2230a_100000225621_100000756337 [0,1,0,0,0,1|1,0,0]=3 1481 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)C 269982a_100000225621_100000756337 [0,1,0,0,0,1|1,0,0]=3 1482 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)C 26a_100000225621_100000185113 [0,1,0,0,0,1|1,0,0]=3 1483 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)N 2230a_100000225621_100000231043 [0,1,0,0,0,1|1,0,0]=3 1484 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)N 269982a_100000225621_100000231043 [0,1,0,0,0,1|1,0,0]=3 1485 B14R1.2879 CCN(C)Cc1ccc(cc1)C(=O)[O-] 26a_100000225621_100016998105 [0,1,0,0,0,1|0,0,1]=3 1486 B14R1.2879 CCN(C)Cc1ccc(cc1)C(C)O 26a_100000225621_100000754508 [0,1,0,0,0,1|1,0,1]=4 1487 B14R1.2879 CCN(C)Cc1ccc(cc1)S(=O)C 26a_100000225621_200000064373 [0,1,0,0,0,1|2,0,0]=4 1488 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100000225621_100000181861 [0,1,0,0,0,1|1,0,1]=4 1489 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_100000210202 [0,1,0,0,0,1|1,0,1]=4 1490 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100103154555_200000210301 [0,1,0,0,0,1|1,0,1]=4 1491 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100000225621_100000184243 [0,1,0,0,0,1|1,0,1]=4 1492 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100000204670 [0,1,0,0,0,1|1,0,1]=4 1493 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100103154555_200000210301 [0,1,0,0,0,1|1,0,1]=4 1494 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 26a_100000225621_100000185810 [0,1,0,0,0,1|1,0,1]=4 1495 B14R1.2879 CCN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 2230a_100103154555_200025704644 [0,1,0,0,0,1|1,0,1]=4 1496 B14R1.2879 CCN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 269982a_100103154555_200025704644 [0,1,0,0,0,1|1,0,1]=4 1497 B14R1.2879 CN(C)c1ccc(cc1)CC(=O)CF 1458a_100011218386_100015361967 [0,1,0,0,0,1|1,0,0]=3 1498 B14R1.2879 CN(C)c1ccc(cc1)NC(=O)CO 22a_100016997997_100000210174 [0,1,0,0,0,1|0,0,0]=2 1499 B14R1.2879 CN(C)c1ccc(cc1)NC(=O)CO 527a_100016997997_100000210174 [0,1,0,0,0,1|0,0,0]=2 1500 B14R1.2879 CN(CF)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100015361967 [0,1,0,0,0,1|1,0,1]=4 1501 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 11a_106832991635_100000689720 [0,1,0,0,0,1|2,0,0]=4 1502 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 1626a_100102657272_100000689720 [0,1,0,0,0,1|2,0,0]=4 1503 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 240690a_100102657272_100000689720 [0,1,0,0,0,1|2,0,0]=4 1504 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 527a_100102657272_100000689720 [0,1,0,0,0,1|2,0,0]=4 1505 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 11a_106832991635_100011218386 [0,1,0,0,0,1|1,0,0]=3 1506 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 1626a_100102657272_100011218386 [0,1,0,0,0,1|1,0,0]=3 1507 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 240690a_100102657272_100011218386 [0,1,0,0,0,1|1,0,0]=3 1508 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 527a_100102657272_100011218386 [0,1,0,0,0,1|1,0,0]=3 1509 B14R1.2879 CNC(=O)Nc1ccc(cc1)C(C)C 2430a_100000210773_100102657272 [0,1,0,0,0,1|2,0,0]=4 1510 B14R1.2879 CNC(=O)Nc1ccc(cc1)N(C)C 2430a_100016997997_100102657272 [0,1,0,0,0,1|1,0,0]=3 1511 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000111013_200000210301 [0,1,0,0,0,1|2,0,0]=4 1512 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000111013_200025704644 [0,1,0,0,0,1|2,0,0]=4 1513 B14R1.2879 COC(C)Sc1ccc(cc1)C(=O)C 62a_100000185465_100009879195 [0,1,0,0,0,1|2,0,0]=4 1514 B14R1.2879 COC(C)Sc1ccc(cc1)C(=O)C 62a_100009879195_100000185465 [0,1,0,0,0,1|2,0,0]=4 1515 B14R1.2879 COC(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_100009879195 [0,1,0,0,0,1|2,0,0]=4 1516 B14R1.2879 COC(C)Sc1ccc(cc1)C(=O)N 62a_100009879195_100000162191 [0,1,0,0,0,1|2,0,0]=4 1517 B14R1.2879 COC(C)Sc1ccc(cc1)N(C)C 62a_100000210421_100009879195 [0,1,0,0,0,1|1,0,1]=4 1518 B14R1.2879 COC(C)Sc1ccc(cc1)N(C)C 62a_100009879195_100000210421 [0,1,0,0,0,1|1,0,1]=4 1519 B14R1.2879 C[C@H](CF)Nc1ccc(cc1)C(=O)N 27a_100102880703_100000162191 [0,1,0,0,0,1|2,0,0]=4 1520 B14R1.2879 C[C@H](CO)Nc1ccc(cc1)C(=O)N 27a_100000737577_100000162191 [0,1,0,0,0,1|2,0,0]=4 1521 B14R1.2879 C[C@H](CO)Sc1ccc(cc1)C(=O)N 62a_100000162191_100016084084 [0,1,0,0,0,1|2,0,0]=4 1522 B14R1.2879 C[C@H](CO)Sc1ccc(cc1)C(=O)N 62a_100016084084_100000162191 [0,1,0,0,0,1|2,0,0]=4 1523 B14R1.2879 C[C@H](CO)Sc1ccc(cc1)N(C)C 62a_100000210421_100016084084 [0,1,0,0,0,1|1,0,1]=4 1524 B14R1.2879 C[C@H](CO)Sc1ccc(cc1)N(C)C 62a_100016084084_100000210421 [0,1,0,0,0,1|1,0,1]=4 1525 B14R1.5801 CC(=Cc1ccc(c(c1)Br)C(=O)N)C 271570a_100102525489_200010146565 [0,1,0,0,0,1|2,0,0]=4 1526 B14R1.5801 CC(=Cc1ccc(c(c1)C)C(=O)N)C 271570a_100102525489_100011327924 [0,1,0,0,0,1|2,0,0]=4 1527 B14R1.5801 CC(=Cc1ccc(c(c1)F)C(=O)N)C 271570a_100102525489_100000216903 [0,1,0,0,0,1|2,0,0]=4 1528 B14R1.5801 CC(=Cc1ccc(c(c1)N)C(=O)N)C 271570a_100102525489_100012349972 [0,1,0,0,0,1|2,0,0]=4 1529 B14R1.5801 CC(=Cc1ccc(c(c1)N)N(C)C)C 271570a_100102525489_100000737018 [0,1,0,0,0,1|2,0,0]=4 1530 B14R1.5801 CC(=Cc1ccc(c(c1)O)C(=O)N)C 271570a_100102525489_100011550861 [0,1,0,0,0,1|2,0,0]=4 1531 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 11a_100011534197_100015343762 [0,1,0,0,0,1|1,0,0]=3 1532 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 1626a_100011534197_100015343762 [0,1,0,0,0,1|1,0,0]=3 1533 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 22a_100011534197_100000070787 [0,1,0,0,0,1|1,0,0]=3 1534 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 527a_100011534197_100103153847 [0,1,0,0,0,1|1,0,0]=3 1535 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 11a_100000005830_100015343762 [0,1,0,0,0,1|2,0,0]=4 1536 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 1626a_100000005830_100015343762 [0,1,0,0,0,1|2,0,0]=4 1537 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 22a_100000005830_100000070787 [0,1,0,0,0,1|2,0,0]=4 1538 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 527a_100000005830_100103153847 [0,1,0,0,0,1|2,0,0]=4 1539 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 11a_100000738307_100015343762 [0,1,0,0,0,1|1,0,0]=3 1540 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 1626a_100000738307_100015343762 [0,1,0,0,0,1|1,0,0]=3 1541 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 22a_100000738307_100000070787 [0,1,0,0,0,1|1,0,0]=3 1542 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 527a_100000738307_100103153847 [0,1,0,0,0,1|1,0,0]=3 1543 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 11a_100000742791_100015343762 [0,1,0,0,0,1|1,0,0]=3 1544 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 1626a_100000742791_100015343762 [0,1,0,0,0,1|1,0,0]=3 1545 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 22a_100000742791_100000070787 [0,1,0,0,0,1|1,0,0]=3 1546 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 527a_100000742791_100103153847 [0,1,0,0,0,1|1,0,0]=3 1547 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 11a_100011248830_100015343762 [0,1,0,0,0,1|1,0,0]=3 1548 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 1626a_100011248830_100015343762 [0,1,0,0,0,1|1,0,0]=3 1549 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 22a_100011248830_100000070787 [0,1,0,0,0,1|1,0,0]=3 1550 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 527a_100011248830_100103153847 [0,1,0,0,0,1|1,0,0]=3 1551 B14R1.5801 CC(=O)c1ccc(cc1Br)OC(C)C 34a_100012340537_100000210206 [0,1,0,0,0,1|2,0,0]=4 1552 B14R1.5801 CC(=O)c1ccc(cc1Br)OC(C)C 7a_100012340537_100000210206 [0,1,0,0,0,1|2,0,0]=4 1553 B14R1.5801 CC(=O)c1ccc(cc1C)C=C(C)C 271570a_100102525489_100012360112 [0,1,0,0,0,1|2,0,0]=4 1554 B14R1.5801 CC(=O)c1ccc(cc1C)OC(C)C 34a_100000702595_100000210206 [0,1,0,0,0,1|2,0,0]=4 1555 B14R1.5801 CC(=O)c1ccc(cc1C)OC(C)C 7a_100000702595_100000210206 [0,1,0,0,0,1|2,0,0]=4 1556 B14R1.5801 CC(=O)c1ccc(cc1C)SC(C)C 62a_100000210206_100012360112 [0,1,0,0,0,1|2,0,0]=4 1557 B14R1.5801 CC(=O)c1ccc(cc1C)SC(C)C 62a_100012360112_100000210206 [0,1,0,0,0,1|2,0,0]=4 1558 B14R1.5801 CC(=O)c1ccc(cc1Cl)OC(C)C 1458a_100011780059_200000210301 [0,1,0,0,0,1|2,0,0]=4 1559 B14R1.5801 CC(=O)c1ccc(cc1Cl)OC(C)C 34a_100011933989_100000210206 [0,1,0,0,0,1|2,0,0]=4 1560 B14R1.5801 CC(=O)c1ccc(cc1Cl)OC(C)C 7a_100011933989_100000210206 [0,1,0,0,0,1|2,0,0]=4 1561 B14R1.5801 CC(=O)c1ccc(cc1F)C=C(C)C 271570a_100102525489_100000690205 [0,1,0,0,0,1|2,0,0]=4 1562 B14R1.5801 CC(=O)c1ccc(cc1F)NC(C)C 27a_100138425928_100000690205 [0,1,0,0,0,1|2,0,0]=4 1563 B14R1.5801 CC(=O)c1ccc(cc1F)OC(C)C 34a_100000752407_100000210206 [0,1,0,0,0,1|2,0,0]=4 1564 B14R1.5801 CC(=O)c1ccc(cc1F)OC(C)C 7a_100000752407_100000210206 [0,1,0,0,0,1|2,0,0]=4 1565 B14R1.5801 CC(=O)c1ccc(cc1F)SC(C)C 62a_100000690205_100000210206 [0,1,0,0,0,1|2,0,0]=4 1566 B14R1.5801 CC(=O)c1ccc(cc1N)C=C(C)C 271570a_100102525489_100011590516 [0,1,0,0,0,1|2,0,0]=4 1567 B14R1.5801 CC(=O)c1ccc(cc1N)SC(C)C 62a_100011590516_100000210206 [0,1,0,0,0,1|2,0,0]=4 1568 B14R1.5801 CC(=O)c1ccc(cc1O)C=C(C)C 271570a_100102525489_100000188348 [0,1,0,0,0,1|2,0,0]=4 1569 B14R1.5801 CC(C)Nc1ccc(c(c1)Br)C(=O)N 27a_100138425928_200010146565 [0,1,0,0,0,1|2,0,0]=4 1570 B14R1.5801 CC(C)Nc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_100000210206 [0,1,0,0,0,1|2,0,0]=4 1571 B14R1.5801 CC(C)Nc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_100000210206 [0,1,0,0,0,1|2,0,0]=4 1572 B14R1.5801 CC(C)Nc1ccc(c(c1)F)C(=O)N 27a_100138425928_100000216903 [0,1,0,0,0,1|2,0,0]=4 1573 B14R1.5801 CC(C)Nc1ccc(c(c1)F)C(=O)N 34a_100000749959_100000210206 [0,1,0,0,0,1|2,0,0]=4 1574 B14R1.5801 CC(C)Nc1ccc(c(c1)F)C(=O)N 7a_100000749959_100000210206 [0,1,0,0,0,1|2,0,0]=4 1575 B14R1.5801 CC(C)Nc1ccc(c(c1)O)C(=O)N 34a_100000223280_100000210206 [0,1,0,0,0,1|2,0,0]=4 1576 B14R1.5801 CC(C)Nc1ccc(c(c1)O)C(=O)N 7a_100000223280_100000210206 [0,1,0,0,0,1|2,0,0]=4 1577 B14R1.5801 CC(C)Oc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_100000210206 [0,1,0,0,0,1|2,0,0]=4 1578 B14R1.5801 CC(C)Oc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_100000210206 [0,1,0,0,0,1|2,0,0]=4 1579 B14R1.5801 CC(C)Oc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100011780059_200025704644 [0,1,0,0,0,1|2,0,0]=4 1580 B14R1.5801 CC(C)Oc1ccc(c(c1)F)C(=O)N 34a_200012186767_100000210206 [0,1,0,0,0,1|2,0,0]=4 1581 B14R1.5801 CC(C)Oc1ccc(c(c1)F)C(=O)N 7a_200012186767_100000210206 [0,1,0,0,0,1|2,0,0]=4 1582 B14R1.5801 CC(C)Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_100000210206 [0,1,0,0,0,1|2,0,0]=4 1583 B14R1.5801 CC(C)Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_100000210206 [0,1,0,0,0,1|2,0,0]=4 1584 B14R1.5801 CC(C)Sc1ccc(c(c1)Br)C(=O)N 62a_200010146565_100000210206 [0,1,0,0,0,1|2,0,0]=4 1585 B14R1.5801 CC(C)Sc1ccc(c(c1)F)C(=O)N 62a_100000216903_100000210206 [0,1,0,0,0,1|2,0,0]=4 1586 B14R1.5801 CC(C)Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_100000210206 [0,1,0,0,0,1|2,0,0]=4 1587 B14R1.5801 CC(C)Sc1ccc(c(c1)O)C(=O)N 62a_100011550861_100000210206 [0,1,0,0,0,1|2,0,0]=4 1588 B14R1.5801 CN(C)Cc1ccc(c(c1)Br)[N+](=O)[O-] 270004a_100102631434_100009998837 [0,1,0,0,0,1|1,0,1]=4 1589 B14R1.5801 CN(C)Cc1ccc(c(c1)Cl)[N+](=O)[O-] 270004a_100102631434_100000070945 [0,1,0,0,0,1|1,0,1]=4 1590 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 2230a_100102631434_100000687068 [0,1,0,0,0,1|1,0,1]=4 1591 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 269982a_100102631434_100000687068 [0,1,0,0,0,1|1,0,1]=4 1592 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 270004a_100102631434_100011934122 [0,1,0,0,0,1|1,0,1]=4 1593 B14R1.5801 Cc1cc(ccc1C(=O)N)NC(C)C 27a_100138425928_100011327924 [0,1,0,0,0,1|2,0,0]=4 1594 B14R1.5801 Cc1cc(ccc1C(=O)N)NC(C)C 34a_200000751758_100000210206 [0,1,0,0,0,1|2,0,0]=4 1595 B14R1.5801 Cc1cc(ccc1C(=O)N)NC(C)C 7a_200000751758_100000210206 [0,1,0,0,0,1|2,0,0]=4 1596 B14R1.5801 Cc1cc(ccc1C(=O)N)SC(C)C 62a_100000210206_100011327924 [0,1,0,0,0,1|2,0,0]=4 1597 B14R1.5801 Cc1cc(ccc1C(=O)N)SC(C)C 62a_100011327924_100000210206 [0,1,0,0,0,1|2,0,0]=4 1598 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 2230a_100102631434_100009816690 [0,1,0,0,0,1|1,0,1]=4 1599 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 269982a_100102631434_100009816690 [0,1,0,0,0,1|1,0,1]=4 1600 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 270004a_100102631434_100000050484 [0,1,0,0,0,1|1,0,1]=4 1601 B14R1.6402 C=C(C)c1ccc(cc1)C(=O)N(C)C 11a_100102631434_200009908186 [0,1,0,0,0,1|2,0,0]=4 1602 B14R1.6402 C=C(C)c1ccc(cc1)C(=O)N(C)C 1626a_100102631434_200009908186 [0,1,0,0,0,1|2,0,0]=4 1603 B14R1.6402 C=C(C)c1ccc(cc1)C(=O)N(C)C 240690a_100102631434_200009908186 [0,1,0,0,0,1|2,0,0]=4 1604 B14R1.6402 C=C(C)c1ccc(cc1)C(=O)N(C)C 271570a_100000694244_100000159574 [0,1,0,0,0,1|2,0,0]=4 1605 B14R1.6402 C=C(C)c1ccc(cc1)C(=O)N(C)C 527a_100102631434_200009908186 [0,1,0,0,0,1|2,0,0]=4 1606 B14R1.6402 CC(=C(C)c1ccc(cc1)C(=O)N)C 271570a_200000049429_100000162191 [0,1,0,0,0,1|2,0,0]=4 1607 B14R1.6402 CC(=C(C)c1ccc(cc1)N(C)C)C 271570a_200000049429_100000210421 [0,1,0,0,0,1|2,0,0]=4 1608 B14R1.6402 CC(=O)C(C)c1ccc(cc1)C(C)C 1458a_100000070787_200000700246 [0,1,0,0,0,1|2,0,0]=4 1609 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 11a_100000688768_100015343762 [0,1,0,0,0,1|2,0,0]=4 1610 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 1626a_100000688768_100015343762 [0,1,0,0,0,1|2,0,0]=4 1611 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 22a_100000688768_100000070787 [0,1,0,0,0,1|2,0,0]=4 1612 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 527a_100000688768_100103153847 [0,1,0,0,0,1|2,0,0]=4 1613 B14R1.6402 CC(=O)c1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000185465 [0,1,0,0,0,1|2,0,0]=4 1614 B14R1.6402 CC(C)C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_100000210206 [0,1,0,0,0,1|2,0,0]=4 1615 B14R1.6402 CC(C)N(C)c1ccc(cc1)C(=O)N 27a_200000211004_100000162191 [0,1,0,0,0,1|2,0,0]=4 1616 B14R1.6402 CC(O)c1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000076921 [0,1,0,0,0,1|1,0,1]=4 1617 B14R1.6402 CC(c1ccc(cc1)[N+](=O)[O-])N(C)C 2230a_100102631434_100000684656 [0,1,0,0,0,1|1,0,1]=4 1618 B14R1.6402 CC(c1ccc(cc1)[N+](=O)[O-])N(C)C 269982a_100102631434_100000684656 [0,1,0,0,0,1|1,0,1]=4 1619 B14R1.6402 CN(C)C(=O)c1ccc(cc1)C(=O)N 11a_100102631434_100000230133 [0,1,0,0,0,1|1,0,0]=3 1620 B14R1.6402 CN(C)C(=O)c1ccc(cc1)C(=O)N 1626a_100102631434_100000230133 [0,1,0,0,0,1|1,0,0]=3 1621 B14R1.6402 CN(C)C(=O)c1ccc(cc1)C(=O)N 240690a_100102631434_100000230133 [0,1,0,0,0,1|1,0,0]=3 1622 B14R1.6402 CN(C)C(=O)c1ccc(cc1)S(=O)C 1626a_100102631434_200000217594 [0,1,0,0,0,1|2,0,0]=4 1623 B14R1.6402 CN(C)C(=O)c1ccc(cc1)S(=O)C 240690a_100102631434_200000217594 [0,1,0,0,0,1|2,0,0]=4 1624 B14R1.6402 CN(C)C(=O)c1ccc(cc1)S(=O)C 527a_100102631434_200000217594 [0,1,0,0,0,1|2,0,0]=4 1625 B14R1.6402 CN(C)C(=O)c1ccc(cc1)[N+](=O)[O-] 11a_100102631434_100000185811 [0,1,0,0,0,1|1,0,1]=4 1626 B14R1.6402 CN(C)C(=O)c1ccc(cc1)[N+](=O)[O-] 1626a_100102631434_100000185811 [0,1,0,0,0,1|1,0,1]=4 1627 B14R1.6402 CN(C)C(=O)c1ccc(cc1)[N+](=O)[O-] 240690a_100102631434_100000185811 [0,1,0,0,0,1|1,0,1]=4 1628 B14R1.6402 CN(C)C(=O)c1ccc(cc1)[N+](=O)[O-] 527a_100102631434_100000185811 [0,1,0,0,0,1|1,0,1]=4 1629 B14R1.43 C=C(C)c1ccc(c(c1)C=O)N(C)C 271570a_100000694244_100012753127 [0,2,0,0,0,0|2,0,0]=4 1630 B14R1.43 CC(=O)c1ccc(c(c1)C#N)N(C)C 27a_100102631434_100010125495 [0,2,0,0,0,0|1,0,0]=3 1631 B14R1.43 CC(=O)c1ccc(cc1O[13CH3])N(C)C 34a_100000684426_200025704644 [0,2,0,0,0,0|1,0,0]=3 1632 B14R1.43 COc1cc(ccc1C(=O)C)N(C)C 34a_100000684426_200000210301 [0,2,0,0,0,0|1,0,0]=3 1633 B14R1.43 COc1cc(ccc1N(C)C)C(=O)N 27a_100102631434_100009817049 [0,2,0,0,0,0|1,0,0]=3 1634 B14R1.747 C=C(C)c1ccc(cc1Br)C(=O)OC 271570a_100000694244_100011294788 [0,2,0,0,0,0|1,0,1]=4 1635 B14R1.747 C=C(C)c1ccc(cc1C)C(=O)OC 271570a_100000694244_100011215878 [0,2,0,0,0,0|1,0,1]=4 1636 B14R1.747 C=C(C)c1ccc(cc1Cl)C(=O)OC 271570a_100000694244_100012356344 [0,2,0,0,0,0|1,0,1]=4 1637 B14R1.747 C=C(C)c1ccc(cc1F)C(=O)OC 271570a_100000694244_100000703229 [0,2,0,0,0,0|1,0,1]=4 1638 B14R1.747 C=C(C)c1ccc(cc1N)C(=O)OC 271570a_100000694244_100011450966 [0,2,0,0,0,0|1,0,1]=4 1639 B14R1.747 C=C(C)c1ccc(cc1O)C(=O)OC 271570a_100000694244_100012350776 [0,2,0,0,0,0|1,0,1]=4 1640 B14R1.747 CC(C)c1ccc(cc1Br)C(=O)CF 1458a_100010235942_100015361967 [0,2,0,0,0,0|2,0,0]=4 1641 B14R1.747 CCC(=O)c1ccc(c(c1)Br)C(C)C 1458a_100010235942_100000210202 [0,2,0,0,0,0|2,0,0]=4 1642 B14R1.747 CCN(C)c1ccc(c(c1)C)[N+](=O)[O-] 2230a_100000686994_100000210202 [0,2,0,0,0,0|1,0,1]=4 1643 B14R1.747 CCN(C)c1ccc(c(c1)C)[N+](=O)[O-] 269982a_100000686994_100000204670 [0,2,0,0,0,0|1,0,1]=4 1644 B14R1.747 CCN(C)c1ccc(c(c1)C)[N+](=O)[O-] 34a_100000686994_100000210202 [0,2,0,0,0,0|1,0,1]=4 1645 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 11a_106832991635_100010235942 [0,2,0,0,0,0|2,0,0]=4 1646 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 1626a_100102657272_100010235942 [0,2,0,0,0,0|2,0,0]=4 1647 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 240690a_100102657272_100010235942 [0,2,0,0,0,0|2,0,0]=4 1648 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 527a_100102657272_100010235942 [0,2,0,0,0,0|2,0,0]=4 1649 B14R1.747 CNC(=O)c1ccc(c(c1)C)N(C)C 27a_100102631434_200013065384 [0,2,0,0,0,0|1,0,0]=3 1650 B14R1.747 COC(=O)c1cc(c(nn1)N(C)C)C 27a_100102631434_100102422153 [0,2,0,0,0,0|2,0,0]=4 1651 B14R1.747 COC(=O)c1ccc(c(c1)Br)C(=O)C 1458a_200010202026_200000210301 [0,2,0,0,0,0|2,0,0]=4 1652 B14R1.747 COC(=O)c1ccc(c(c1)Br)C(=O)[13CH3] 1458a_200010202026_200025704644 [0,2,0,0,0,0|2,0,0]=4 1653 B14R1.747 COC(=O)c1ccc(c(c1)Cl)C(=O)C 1458a_100010291778_200000210301 [0,2,0,0,0,0|2,0,0]=4 1654 B14R1.747 COC(=O)c1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100010291778_200025704644 [0,2,0,0,0,0|2,0,0]=4 1655 B14R1.747 COC(=O)c1ccc(c(c1)F)C(=O)C 1458a_100000703384_200000210301 [0,2,0,0,0,0|2,0,0]=4 1656 B14R1.747 COC(=O)c1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000703384_200025704644 [0,2,0,0,0,0|2,0,0]=4 1657 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)C 1458a_100000101776_200000210301 [0,2,0,0,0,0|2,0,0]=4 1658 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000101776_200025704644 [0,2,0,0,0,0|2,0,0]=4 1659 B14R1.747 COC(=O)c1ccc(c(c1)O)C(C)C 271570a_203496583355_200010236285 [0,2,0,0,0,0|1,0,0]=3 1660 B14R1.747 COC(=O)c1ccc(c(n1)F)N(C)C 27a_100102631434_100010189630 [0,2,0,0,0,0|1,0,0]=3 1661 B14R1.747 COC(=O)c1cnc(c(c1)Br)N(C)C 27a_100102631434_100010114297 [0,2,0,0,0,0|1,0,0]=3 1662 B14R1.747 COC(=O)c1cnc(c(c1)C)N(C)C 27a_100102631434_100009862495 [0,2,0,0,0,0|1,0,0]=3 1663 B14R1.747 COC(=O)c1cnc(c(c1)F)N(C)C 27a_100102631434_100009877320 [0,2,0,0,0,0|1,0,0]=3 1664 B14R1.747 COC(=O)c1cnc(c(c1)N)N(C)C 27a_100102631434_100000079130 [0,2,0,0,0,0|1,0,0]=3 1665 B14R1.747 COC(=O)c1cnc(c(n1)C)N(C)C 27a_100102631434_100000109192 [0,2,0,0,0,0|2,0,0]=4 1666 B14R1.747 Cc1cc(ccc1N(C)C)C(=O)NN 27a_100102631434_100012339724 [0,2,0,0,0,0|1,0,0]=3 1667 B14R1.747 Cc1cc(ccc1[N+](=O)[O-])N(C)CF 269982a_100000686994_100015361967 [0,2,0,0,0,0|1,0,1]=4 1668 B14R1.747 Cc1cc(ccc1[N+](=O)[O-])N(C)CF 34a_100000686994_100015361967 [0,2,0,0,0,0|1,0,1]=4 1669 B14R1.1128 C=C(C)c1ccc(c(c1)Br)C(=O)OC 271570a_100000694244_100010247156 [0,2,0,0,0,0|1,0,1]=4 1670 B14R1.1128 C=C(C)c1ccc(c(c1)C)C(=O)OC 271570a_100000694244_100000747612 [0,2,0,0,0,0|1,0,1]=4 1671 B14R1.1128 C=C(C)c1ccc(c(c1)Cl)C(=O)OC 271570a_100000694244_100000060724 [0,2,0,0,0,0|1,0,1]=4 1672 B14R1.1128 C=C(C)c1ccc(c(c1)F)C(=O)OC 271570a_100000694244_100000216654 [0,2,0,0,0,0|1,0,1]=4 1673 B14R1.1128 C=C(C)c1ccc(c(c1)N)C(=O)OC 271570a_100000694244_100011373473 [0,2,0,0,0,0|1,0,1]=4 1674 B14R1.1128 C=C(C)c1ccc(c(c1)O)C(=O)OC 271570a_100000694244_100000062286 [0,2,0,0,0,0|1,0,1]=4 1675 B14R1.1128 CC(C)c1ccc(c(c1)F)C(=O)CF 1458a_100011941423_100015361967 [0,2,0,0,0,0|2,0,0]=4 1676 B14R1.1128 CCC(=O)c1ccc(cc1F)C(C)C 1458a_100011941423_100000210202 [0,2,0,0,0,0|2,0,0]=4 1677 B14R1.1128 CCC(=O)c1ccc(cc1F)N(C)C 27a_100102631434_100012360378 [0,2,0,0,0,0|1,0,0]=3 1678 B14R1.1128 CCC(=O)c1ccc(cc1O)N(C)C 1458a_200000073653_100000210202 [0,2,0,0,0,0|1,0,0]=3 1679 B14R1.1128 CCN(C)c1ccc(cc1Br)[N+](=O)[O-] 269982a_200000714926_200000210301 [0,2,0,0,0,0|1,0,1]=4 1680 B14R1.1128 CCN(C)c1ccc(cc1Br)[N+](=O)[O-] 269982a_200011534181_100000204670 [0,2,0,0,0,0|1,0,1]=4 1681 B14R1.1128 CCN(C)c1ccc(cc1C)[N+](=O)[O-] 2230a_200011219100_100000210202 [0,2,0,0,0,0|1,0,1]=4 1682 B14R1.1128 CCN(C)c1ccc(cc1C)[N+](=O)[O-] 269982a_200011219100_100000204670 [0,2,0,0,0,0|1,0,1]=4 1683 B14R1.1128 CCN(C)c1ccc(cc1C)[N+](=O)[O-] 34a_200011219100_100000210202 [0,2,0,0,0,0|1,0,1]=4 1684 B14R1.1128 CCN(C)c1ccc(cc1F)[N+](=O)[O-] 269982a_100011248812_100000204670 [0,2,0,0,0,0|1,0,1]=4 1685 B14R1.1128 CCN(C)c1ccc(cc1F)[N+](=O)[O-] 34a_100011248812_100000210202 [0,2,0,0,0,0|1,0,1]=4 1686 B14R1.1128 CCN([13CH3])c1ccc(cc1Br)[N+](=O)[O-] 269982a_200000714926_200025704644 [0,2,0,0,0,0|1,0,1]=4 1687 B14R1.1128 CN(C)c1ccc(c(c1)O)C(=O)CF 1458a_200000073653_100015361967 [0,2,0,0,0,0|1,0,0]=3 1688 B14R1.1128 CN(CF)c1ccc(cc1Br)[N+](=O)[O-] 269982a_200011534181_100015361967 [0,2,0,0,0,0|1,0,1]=4 1689 B14R1.1128 CN(CF)c1ccc(cc1F)[N+](=O)[O-] 269982a_100011248812_100015361967 [0,2,0,0,0,0|1,0,1]=4 1690 B14R1.1128 CN(CF)c1ccc(cc1F)[N+](=O)[O-] 34a_100011248812_100015361967 [0,2,0,0,0,0|1,0,1]=4 1691 B14R1.1128 CNC(=O)c1ccc(cc1F)C(C)C 11a_106832991635_100011941423 [0,2,0,0,0,0|2,0,0]=4 1692 B14R1.1128 CNC(=O)c1ccc(cc1F)C(C)C 1626a_100102657272_100011941423 [0,2,0,0,0,0|2,0,0]=4 1693 B14R1.1128 CNC(=O)c1ccc(cc1F)C(C)C 240690a_100102657272_100011941423 [0,2,0,0,0,0|2,0,0]=4 1694 B14R1.1128 CNC(=O)c1ccc(cc1F)C(C)C 527a_100102657272_100011941423 [0,2,0,0,0,0|2,0,0]=4 1695 B14R1.1128 CNC(=O)c1ccc(cc1F)N(C)C 27a_100102631434_100000233932 [0,2,0,0,0,0|1,0,0]=3 1696 B14R1.1128 CNC(=O)c1ccc(cc1O)N(C)C 240690a_100102657272_200000073653 [0,2,0,0,0,0|1,0,0]=3 1697 B14R1.1128 COC(=O)c1ccc(cc1Br)C(=O)C 1458a_200009992943_200000210301 [0,2,0,0,0,0|2,0,0]=4 1698 B14R1.1128 COC(=O)c1ccc(cc1Br)C(=O)[13CH3] 1458a_200009992943_200025704644 [0,2,0,0,0,0|2,0,0]=4 1699 B14R1.1128 COC(=O)c1ccc(cc1C)C(=O)C 1458a_100009860594_200000210301 [0,2,0,0,0,0|2,0,0]=4 1700 B14R1.1128 COC(=O)c1ccc(cc1C)C(=O)[13CH3] 1458a_100009860594_200025704644 [0,2,0,0,0,0|2,0,0]=4 1701 B14R1.1128 COC(=O)c1ccc(cc1Cl)C(=O)C 1458a_100009992935_200000210301 [0,2,0,0,0,0|2,0,0]=4 1702 B14R1.1128 COC(=O)c1ccc(cc1Cl)C(=O)[13CH3] 1458a_100009992935_200025704644 [0,2,0,0,0,0|2,0,0]=4 1703 B14R1.1128 COC(=O)c1ccc(cc1F)C(=O)C 1458a_100000690533_200000210301 [0,2,0,0,0,0|2,0,0]=4 1704 B14R1.1128 COC(=O)c1ccc(cc1F)C(=O)[13CH3] 1458a_100000690533_200025704644 [0,2,0,0,0,0|2,0,0]=4 1705 B14R1.1128 COC(=O)c1ccc(cc1I)C(=O)C 1458a_200010176111_200000210301 [0,2,0,0,0,0|2,0,0]=4 1706 B14R1.1128 COC(=O)c1ccc(cc1I)C(=O)[13CH3] 1458a_200010176111_200025704644 [0,2,0,0,0,0|2,0,0]=4 1707 B14R1.1128 COC(=O)c1ccc(cc1O)C(=O)C 1458a_100000704390_200000210301 [0,2,0,0,0,0|2,0,0]=4 1708 B14R1.1128 COC(=O)c1ccc(cc1O)C(=O)[13CH3] 1458a_100000704390_200025704644 [0,2,0,0,0,0|2,0,0]=4 1709 B14R1.1128 COC(=O)c1ccc(nc1C)N(C)C 27a_100102631434_100000692007 [0,2,0,0,0,0|1,0,0]=3 1710 B14R1.1128 COC(=O)c1cnc(cc1C)N(C)C 27a_100102631434_100009871181 [0,2,0,0,0,0|1,0,0]=3 1711 B14R1.1128 Cc1cc(ccc1N(C)CF)[N+](=O)[O-] 269982a_200011219100_100015361967 [0,2,0,0,0,0|1,0,1]=4 1712 B14R1.1128 Cc1cc(ccc1N(C)CF)[N+](=O)[O-] 34a_200011219100_100015361967 [0,2,0,0,0,0|1,0,1]=4 1713 B14R1.4227 CC(=O)c1ccc(cc1Br)C(C)(C)C 1458a_100010233000_200000210301 [0,2,0,0,0,0|2,0,0]=4 1714 B14R1.4227 CC(=O)c1ccc(cc1O)C(C)(C)C 1458a_100009848251_200000210301 [0,2,0,0,0,0|2,0,0]=4 1715 B14R1.4227 CC(C)(C)c1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100010233000_200025704644 [0,2,0,0,0,0|2,0,0]=4 1716 B14R1.4227 CC(C)(C)c1ccc(c(c1)O)C(=O)[13CH3] 1458a_100009848251_200025704644 [0,2,0,0,0,0|2,0,0]=4 1717 B14R1.6034 CN(C)c1cc(c(cc1F)C(=O)N)F 27a_100102631434_100010244962 [0,2,0,0,0,0|1,0,0]=3 1718 B14R1.6039 CC(=O)c1ccc(c(c1)I)C(C)(C)C 1458a_200012360054_200000210301 [0,2,0,0,0,0|2,0,0]=4 1719 B14R1.6039 CC(C)(C)c1ccc(cc1I)C(=O)[13CH3] 1458a_200012360054_200025704644 [0,2,0,0,0,0|2,0,0]=4 1720 B14R1.6039 CN(C)c1ccc(c(c1)F)S(=O)(=O)C 27a_100102631434_100010245844 [0,2,0,0,0,0|1,0,1]=4 1721 B14R1.6039 CN(C)c1ccc(c(c1)F)S(=O)(=O)N 27a_100102631434_100011219832 [0,2,0,0,0,0|1,0,1]=4 1722 B14R1.15547 C=C(C)c1c(cc(cc1C)N(C)C)C 271570a_100000694244_100011935182 [0,2,0,0,0,0|2,0,0]=4 1723 B14R1.15547 CN(C)c1cc(c(c(c1)F)C(=O)N)F 27a_100102631434_100000695656 [0,2,0,0,0,0|1,0,0]=3 1724 B14R1.15547 Cc1cc(cc(c1C(=O)N)F)N(C)C 27a_100102631434_100016096366 [0,2,0,0,0,0|1,0,0]=3 1725 B14R1.307 CC(=O)c1ccc(cc1)C(C)(C)C#N 1458a_100000724183_200000210301 [0,2,0,0,0,0|2,0,0]=4 1726 B14R1.307 CC(C)(C#N)c1ccc(cc1)C(=O)[13CH3] 1458a_100000724183_200025704644 [0,2,0,0,0,0|2,0,0]=4 1727 B14R1.307 CNS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100102657272_100000185021 [0,2,0,0,0,0|2,0,0]=4 1728 B14R1.307 CNS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100102657272_100000185021 [0,2,0,0,0,0|2,0,0]=4 1729 B14R1.719 CC(C)(C)c1ccc(cc1)C(=O)CF 1458a_100000210226_100015361967 [0,2,0,0,0,0|2,0,0]=4 1730 B14R1.719 CCC(=O)c1ccc(cc1)C(C)(C)C 1458a_100000210226_100000210202 [0,2,0,0,0,0|2,0,0]=4 1731 B14R1.719 CCC(=O)c1ccc(cc1)[Si](C)(C)C 1458a_100009908145_100000210202 [0,2,0,0,0,0|2,0,0]=4 1732 B14R1.719 CCN(C)c1ccc(cc1)S(=O)(=O)C 269982a_100000744783_100000204670 [0,2,0,0,0,0|1,0,1]=4 1733 B14R1.719 CCN(C)c1ccc(cc1)S(=O)(=O)C 34a_100000744783_100000210202 [0,2,0,0,0,0|1,0,1]=4 1734 B14R1.719 CCN(C)c1ccc(cc1)S(=O)(=O)C 7a_100000744783_100000210202 [0,2,0,0,0,0|1,0,1]=4 1735 B14R1.719 CN(CF)c1ccc(cc1)S(=O)(=O)C 269982a_100000744783_100015361967 [0,2,0,0,0,0|1,0,1]=4 1736 B14R1.719 CN(CF)c1ccc(cc1)S(=O)(=O)C 34a_100000744783_100015361967 [0,2,0,0,0,0|1,0,1]=4 1737 B14R1.719 CN(CF)c1ccc(cc1)S(=O)(=O)C 7a_100000744783_100015361967 [0,2,0,0,0,0|1,0,1]=4 1738 B14R1.719 CNC(=O)c1ccc(cc1)C(C)(C)C 11a_106832991635_100000210226 [0,2,0,0,0,0|2,0,0]=4 1739 B14R1.719 CNC(=O)c1ccc(cc1)C(C)(C)C 1626a_100102657272_100000210226 [0,2,0,0,0,0|2,0,0]=4 1740 B14R1.719 CNC(=O)c1ccc(cc1)C(C)(C)C 240690a_100102657272_100000210226 [0,2,0,0,0,0|2,0,0]=4 1741 B14R1.719 CNC(=O)c1ccc(cc1)C(C)(C)C 527a_100102657272_100000210226 [0,2,0,0,0,0|2,0,0]=4 1742 B14R1.719 CNC(=O)c1ccc(cc1)[Si](C)(C)C 11a_106832991635_100009908145 [0,2,0,0,0,0|2,0,0]=4 1743 B14R1.719 CNC(=O)c1ccc(cc1)[Si](C)(C)C 1626a_100102657272_100009908145 [0,2,0,0,0,0|2,0,0]=4 1744 B14R1.719 CNC(=O)c1ccc(cc1)[Si](C)(C)C 240690a_100102657272_100009908145 [0,2,0,0,0,0|2,0,0]=4 1745 B14R1.719 CNC(=O)c1ccc(cc1)[Si](C)(C)C 527a_100102657272_100009908145 [0,2,0,0,0,0|2,0,0]=4 1746 B14R1.719 C[Si](C)(C)c1ccc(cc1)C(=O)CF 1458a_100009908145_100015361967 [0,2,0,0,0,0|2,0,0]=4 1747 B14R1.395 C=C(C)c1ccc(cc1)N(CC)CC 271570a_100000694244_100011216415 [0,2,0,0,0,0|2,0,0]=4 1748 B14R1.395 CCN(CC)c1ccc(cc1)C(=O)C 1458a_100000210703_200000210301 [0,2,0,0,0,0|1,0,0]=3 1749 B14R1.395 CCN(CC)c1ccc(cc1)C(=O)N 27a_100000724800_100000162191 [0,2,0,0,0,0|1,0,0]=3 1750 B14R1.395 CCN(CC)c1ccc(cc1)C(=O)O 269956a_100011218868_100000210202 [0,2,0,0,0,0|0,0,0]=2 1751 B14R1.395 CCN(CC)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210703_200025704644 [0,2,0,0,0,0|1,0,0]=3 1752 B14R1.395 CCN(CC)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156571_100000210202 [0,2,0,0,0,0|1,0,1]=4 1753 B14R1.395 CCN(CC)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156571_100000204670 [0,2,0,0,0,0|1,0,1]=4 1754 B14R1.395 CCN(CC)c1ccc(cc1)[N+](=O)[O-] 34a_100000156571_100000210202 [0,2,0,0,0,0|1,0,1]=4 1755 B14R1.395 CCN(CC)c1ccc(cn1)C(=O)C 27a_100000724800_100000690552 [0,2,0,0,0,0|2,0,0]=4 1756 B14R1.395 CCN(CC)c1ccc(cn1)C(=O)N 27a_100000724800_100000162237 [0,2,0,0,0,0|2,0,0]=4 1757 B14R1.395 CCN(CF)c1ccc(cc1)C(=O)O 269956a_100011218868_100015361967 [0,2,0,0,0,0|0,0,0]=2 1758 B14R1.395 CCN(CF)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156571_100015361967 [0,2,0,0,0,0|1,0,1]=4 1759 B14R1.395 CCN(CF)c1ccc(cc1)[N+](=O)[O-] 34a_100000156571_100015361967 [0,2,0,0,0,0|1,0,1]=4 1760 B14R1.395 COC(OC)c1ccc(cc1)C(=O)C 1458a_200000104780_200000210301 [0,2,0,0,0,0|2,0,0]=4 1761 B14R1.395 COC(OC)c1ccc(cc1)C(=O)[13CH3] 1458a_200000104780_200025704644 [0,2,0,0,0,0|2,0,0]=4 1762 B14R1.610 C#CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000184674 [0,2,0,0,0,0|2,0,0]=4 1763 B14R1.610 C#CCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000184674 [0,2,0,0,0,0|1,0,0]=3 1764 B14R1.610 C#CCN(C)c1ccc(cc1)C(=O)N 27a_100000225692_100000162191 [0,2,0,0,0,0|1,0,0]=3 1765 B14R1.610 C#CCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000038162 [0,2,0,0,0,0|1,0,1]=4 1766 B14R1.610 C#CCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000184674 [0,2,0,0,0,0|1,0,1]=4 1767 B14R1.610 C#CCN(C)c1ccc(cn1)C(=O)C 27a_100000225692_100000690552 [0,2,0,0,0,0|2,0,0]=4 1768 B14R1.610 C#CCN(C)c1ccc(cn1)C(=O)N 27a_100000225692_100000162237 [0,2,0,0,0,0|2,0,0]=4 1769 B14R1.610 C=C(C)c1ccc(cc1)C(=O)CCO 1458a_200009908186_100000211926 [0,2,0,0,0,0|1,0,1]=4 1770 B14R1.610 C=C(C)c1ccc(cc1)C(=O)COC 271570a_100000694244_200011343064 [0,2,0,0,0,0|1,0,1]=4 1771 B14R1.610 C=C(C)c1ccc(cc1)C(=O)OCC 271570a_100000694244_100000170077 [0,2,0,0,0,0|1,0,1]=4 1772 B14R1.610 C=CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210623 [0,2,0,0,0,0|2,0,0]=4 1773 B14R1.610 C=CCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000210623 [0,2,0,0,0,0|1,0,0]=3 1774 B14R1.610 C=CCN(C)c1ccc(cc1)C(=O)O 269956a_200000185622_200000210301 [0,2,0,0,0,0|0,0,0]=2 1775 B14R1.610 C=CCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000210623 [0,2,0,0,0,0|1,0,1]=4 1776 B14R1.610 C=CCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000210623 [0,2,0,0,0,0|1,0,1]=4 1777 B14R1.610 C=CCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100015514636 [0,2,0,0,0,0|1,0,1]=4 1778 B14R1.610 C=CCN([13CH3])c1ccc(cc1)C(=O)O 269956a_200000185622_200025704644 [0,2,0,0,0,0|0,0,0]=2 1779 B14R1.610 CC(=O)c1ccc(cc1)N(C)CCO 1458a_200011623597_200000210301 [0,2,0,0,0,0|1,0,0]=3 1780 B14R1.610 CC(=O)c1ccc(nc1)N(C)CCO 27a_100000210263_100000690552 [0,2,0,0,0,0|2,0,0]=4 1781 B14R1.610 CC(C)c1ccc(cc1)C(=O)CC#N 1458a_100000210772_100011214920 [0,2,0,0,0,0|2,0,0]=4 1782 B14R1.610 CC(C)c1ccc(cc1)C(=O)CCF 1458a_100000210772_100011217306 [0,2,0,0,0,0|2,0,0]=4 1783 B14R1.610 CC(C)c1ccc(cc1)C(=O)CCO 1458a_100000210772_100000211926 [0,2,0,0,0,0|1,0,0]=3 1784 B14R1.610 CC(C)c1ccc(cc1)C(=O)CS[13CH3] 62a_200000751037_200025704644 [0,2,0,0,0,0|1,1,0]=4 1785 B14R1.610 CC(C)c1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_200000751037 [0,2,0,0,0,0|1,1,0]=4 1786 B14R1.610 CC(O)c1ccc(cc1)C(=O)CCO 1458a_100000076921_100000211926 [0,2,0,0,0,0|2,0,0]=4 1787 B14R1.610 CC(OCF)c1ccc(cc1)C(=O)N 7a_200010363529_100015361967 [0,2,0,0,0,0|2,0,0]=4 1788 B14R1.610 CCCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210303 [0,2,0,0,0,0|2,0,0]=4 1789 B14R1.610 CCCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000210303 [0,2,0,0,0,0|1,0,0]=3 1790 B14R1.610 CCCC(=O)c1ccc(nc1)N(C)C 27a_100102631434_200012185933 [0,2,0,0,0,0|2,0,0]=4 1791 B14R1.610 CCCN(C)c1ccc(cc1)C(=O)N 27a_100000747261_100000162191 [0,2,0,0,0,0|1,0,0]=3 1792 B14R1.610 CCCN(C)c1ccc(cc1)C(=O)O 269956a_100000760769_200000210301 [0,2,0,0,0,0|0,0,0]=2 1793 B14R1.610 CCCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000210303 [0,2,0,0,0,0|1,0,1]=4 1794 B14R1.610 CCCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000210303 [0,2,0,0,0,0|1,0,1]=4 1795 B14R1.610 CCCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000210303 [0,2,0,0,0,0|1,0,1]=4 1796 B14R1.610 CCCN(C)c1ccc(cn1)C(=O)C 27a_100000747261_100000690552 [0,2,0,0,0,0|2,0,0]=4 1797 B14R1.610 CCCN(C)c1ccc(cn1)C(=O)N 27a_100000747261_100000162237 [0,2,0,0,0,0|2,0,0]=4 1798 B14R1.610 CCCN([13CH3])c1ccc(cc1)C(=O)O 269956a_100000760769_200025704644 [0,2,0,0,0,0|0,0,0]=2 1799 B14R1.610 CCNC(=O)c1ccc(cc1)C(C)C 11a_100015525214_100000210772 [0,2,0,0,0,0|2,0,0]=4 1800 B14R1.610 CCNC(=O)c1ccc(cc1)C(C)C 240690a_100015525214_100000210772 [0,2,0,0,0,0|2,0,0]=4 1801 B14R1.610 CCNC(=O)c1ccc(cc1)C(C)C 527a_100015525214_100000210772 [0,2,0,0,0,0|2,0,0]=4 1802 B14R1.610 CCNC(=O)c1ccc(cc1)N(C)C 11a_100015525214_100000210873 [0,2,0,0,0,0|1,0,0]=3 1803 B14R1.610 CCNC(=O)c1ccc(cc1)N(C)C 240690a_100015525214_100000210873 [0,2,0,0,0,0|1,0,0]=3 1804 B14R1.610 CCNC(=O)c1ccc(cc1)N(C)C 27a_100102631434_100000155177 [0,2,0,0,0,0|1,0,0]=3 1805 B14R1.610 CCNC(=O)c1ccc(cc1)N(C)C 527a_100015525214_100000210873 [0,2,0,0,0,0|1,0,0]=3 1806 B14R1.610 CCNC(=O)c1ccc(cn1)N(C)C 27a_100102631434_200011781264 [0,2,0,0,0,0|2,0,0]=4 1807 B14R1.610 CCNC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000160145 [0,2,0,0,0,0|2,0,0]=4 1808 B14R1.610 CCN[C@@H](C)c1ccc(cc1)C(=O)O 269956a_100020638929_100000210202 [0,2,0,0,0,0|1,0,0]=3 1809 B14R1.610 CCOC(=O)c1ccc(cc1)C(=O)C 1458a_100000076237_200000210301 [0,2,0,0,0,0|2,0,0]=4 1810 B14R1.610 CCOC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000076237_200025704644 [0,2,0,0,0,0|2,0,0]=4 1811 B14R1.610 CCOC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000170224 [0,2,0,0,0,0|1,0,0]=3 1812 B14R1.610 CCOC(=O)c1ccc(nn1)N(C)C 27a_100102631434_100011933454 [0,2,0,0,0,0|2,0,0]=4 1813 B14R1.610 CCOC(=O)c1cnc(cn1)N(C)C 27a_100102631434_100000707868 [0,2,0,0,0,0|2,0,0]=4 1814 B14R1.610 CCOC(=O)c1cnc(nc1)N(C)C 27a_100102631434_100011935661 [0,2,0,0,0,0|2,0,0]=4 1815 B14R1.610 CCOC(C)c1ccc(cc1)C(=O)N 7a_200010363529_100000210202 [0,2,0,0,0,0|2,0,0]=4 1816 B14R1.610 CN(C)c1ccc(cc1)C(=O)CC#N 1458a_100000210873_100011214920 [0,2,0,0,0,0|1,0,0]=3 1817 B14R1.610 CN(C)c1ccc(cc1)C(=O)CCF 1458a_100000210873_100011217306 [0,2,0,0,0,0|1,0,0]=3 1818 B14R1.610 CN(C)c1ccc(cc1)C(=O)CCO 1458a_100000210873_100000211926 [0,2,0,0,0,0|0,0,0]=2 1819 B14R1.610 CN(C)c1ccc(cc1)C(=O)CS[13CH3] 62a_100009815699_200025704644 [0,2,0,0,0,0|0,1,0]=3 1820 B14R1.610 CN(C)c1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100009815699 [0,2,0,0,0,0|0,1,0]=3 1821 B14R1.610 CN(CC#N)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100011215382 [0,2,0,0,0,0|1,0,1]=4 1822 B14R1.610 CN(CC#N)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100011214920 [0,2,0,0,0,0|1,0,1]=4 1823 B14R1.610 CN(CC=O)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200015260668 [0,2,0,0,0,0|1,0,1]=4 1824 B14R1.610 CN(CC=O)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200015260668 [0,2,0,0,0,0|1,0,1]=4 1825 B14R1.610 CN(CC=O)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200009817547 [0,2,0,0,0,0|1,0,1]=4 1826 B14R1.610 CN(CCF)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100011217306 [0,2,0,0,0,0|1,0,1]=4 1827 B14R1.610 CN(CCF)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100011217306 [0,2,0,0,0,0|1,0,1]=4 1828 B14R1.610 CN(CCF)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100011217306 [0,2,0,0,0,0|1,0,1]=4 1829 B14R1.610 CN(CCO)c1ccc(cc1)C(=O)N 27a_100000210263_100000162191 [0,2,0,0,0,0|1,0,0]=3 1830 B14R1.610 CN(CCO)c1ccc(cc1)C(=O)[13CH3] 1458a_200011623597_200025704644 [0,2,0,0,0,0|1,0,0]=3 1831 B14R1.610 CN(CCO)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000211926 [0,2,0,0,0,0|1,0,1]=4 1832 B14R1.610 CN(CCO)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000211926 [0,2,0,0,0,0|1,0,1]=4 1833 B14R1.610 CN(CCO)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000211926 [0,2,0,0,0,0|1,0,1]=4 1834 B14R1.610 CN(CCO)c1ccc(cn1)C(=O)N 27a_100000210263_100000162237 [0,2,0,0,0,0|2,0,0]=4 1835 B14R1.610 CNCC(=O)c1ccc(cc1)C(C)C 2230a_106832991635_200000751037 [0,2,0,0,0,0|2,0,0]=4 1836 B14R1.610 CNCC(=O)c1ccc(cc1)C(C)C 7a_106832991635_200000751037 [0,2,0,0,0,0|2,0,0]=4 1837 B14R1.610 CNCC(=O)c1ccc(cc1)N(C)C 2230a_106832991635_100009815699 [0,2,0,0,0,0|1,0,0]=3 1838 B14R1.610 CNCC(=O)c1ccc(cc1)N(C)C 7a_106832991635_100009815699 [0,2,0,0,0,0|1,0,0]=3 1839 B14R1.610 CNNC(=O)c1ccc(cc1)C(C)C 22a_100016993582_100000210772 [0,2,0,0,0,0|2,0,0]=4 1840 B14R1.610 CNNC(=O)c1ccc(cc1)N(C)C 22a_100016993582_100000210873 [0,2,0,0,0,0|1,0,0]=3 1841 B14R1.610 COCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000766300 [0,2,0,0,0,0|1,0,1]=4 1842 B14R1.610 COCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000766300 [0,2,0,0,0,0|1,0,1]=4 1843 B14R1.610 CS(=O)c1ccc(cc1)C(=O)CCO 1458a_200000217594_100000211926 [0,2,0,0,0,0|2,0,0]=4 1844 B14R1.610 CSCC(=O)c1ccc(cc1)C(C)C 62a_200000210301_200000751037 [0,2,0,0,0,0|1,1,0]=4 1845 B14R1.610 CSCC(=O)c1ccc(cc1)C(C)C 62a_200000751037_200000210301 [0,2,0,0,0,0|1,1,0]=4 1846 B14R1.610 CSCC(=O)c1ccc(cc1)N(C)C 62a_100009815699_200000210301 [0,2,0,0,0,0|0,1,0]=3 1847 B14R1.610 CSCC(=O)c1ccc(cc1)N(C)C 62a_200000210301_100009815699 [0,2,0,0,0,0|0,1,0]=3 1848 B14R1.610 CSCN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100011218213 [0,2,0,0,0,0|1,0,1]=4 1849 B14R1.610 CSCN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100011218213 [0,2,0,0,0,0|1,0,1]=4 1850 B14R1.610 CSCN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100011218213 [0,2,0,0,0,0|1,0,1]=4 1851 B14R1.610 C[C@H](NCF)c1ccc(cc1)C(=O)O 269956a_100020638929_100015361967 [0,2,0,0,0,0|1,0,0]=3 1852 B14R1.718 CCC(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_100000210202 [0,2,0,0,0,0|2,0,0]=4 1853 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 2230a_100000220287_100000210202 [0,2,0,0,0,0|0,0,0]=2 1854 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 269982a_100000220287_100000204670 [0,2,0,0,0,0|0,0,0]=2 1855 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 34a_100000220287_100000210202 [0,2,0,0,0,0|0,0,0]=2 1856 B14R1.718 CNC(=O)c1ccc(cc1)C(=O)OC 11a_106832991635_100000211811 [0,2,0,0,0,0|2,0,0]=4 1857 B14R1.718 CNC(=O)c1ccc(cc1)C(=O)OC 1626a_100102657272_100000211811 [0,2,0,0,0,0|2,0,0]=4 1858 B14R1.718 CNC(=O)c1ccc(cc1)C(=O)OC 240690a_100102657272_100000211811 [0,2,0,0,0,0|2,0,0]=4 1859 B14R1.718 CNC(=O)c1ccc(cc1)C(=O)OC 527a_100102657272_100000211811 [0,2,0,0,0,0|2,0,0]=4 1860 B14R1.718 CNC(C)c1ccc(cc1)C(=O)OC 2230a_106832991635_100010159609 [0,2,0,0,0,0|1,0,0]=3 1861 B14R1.718 CNC(C)c1ccc(cc1)C(=O)OC 7a_106832991635_100010159609 [0,2,0,0,0,0|1,0,0]=3 1862 B14R1.718 COC(=O)c1ccc(cc1)C(=O)CF 1458a_100000211811_100015361967 [0,2,0,0,0,0|2,0,0]=4 1863 B14R1.718 COC(=O)c1ccc(cc1)C(C)OC 34a_100000036437_200000210301 [0,2,0,0,0,0|1,0,0]=3 1864 B14R1.718 COC(=O)c1ccc(cc1)C(C)OC 7a_100000036437_200000210301 [0,2,0,0,0,0|1,0,0]=3 1865 B14R1.718 COC(=O)c1ccc(cc1)C(C)O[13CH3] 34a_100000036437_200025704644 [0,2,0,0,0,0|1,0,0]=3 1866 B14R1.718 COC(=O)c1ccc(cc1)C(C)O[13CH3] 7a_100000036437_200025704644 [0,2,0,0,0,0|1,0,0]=3 1867 B14R1.718 COC(=O)c1ccc(cc1)C(C)SC 62a_100010159609_200000210301 [0,2,0,0,0,0|1,0,0]=3 1868 B14R1.718 COC(=O)c1ccc(cc1)C(C)SC 62a_200000210301_100010159609 [0,2,0,0,0,0|1,0,0]=3 1869 B14R1.718 COC(=O)c1ccc(cc1)C(C)S[13CH3] 62a_100010159609_200025704644 [0,2,0,0,0,0|1,0,0]=3 1870 B14R1.718 COC(=O)c1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100010159609 [0,2,0,0,0,0|1,0,0]=3 1871 B14R1.718 COC(=O)c1ccc(cc1)N(C)CF 269982a_100000220287_100015361967 [0,2,0,0,0,0|0,0,0]=2 1872 B14R1.718 COC(=O)c1ccc(cc1)N(C)CF 34a_100000220287_100015361967 [0,2,0,0,0,0|0,0,0]=2 1873 B12R2.9 C=Cc1ccc(cc1)C2CC2 271570a_100011290941_100009820665 [1,0,0,1,0,0|2,0,0]=4 1874 B12R2.9 O=Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186029 [1,0,0,1,0,0|1,0,0]=3 1875 B12R2.9 O=Cc1ccc(cn1)C2CC2 271570a_100011220607_100000754260 [1,0,0,1,0,0|2,0,0]=4 1876 B12R2.9 O=Cc1ccc(nc1)C2CC2 271570a_100011220607_100000766901 [1,0,0,1,0,0|2,0,0]=4 1877 B12R2.9 OCc1ccc(cc1)C2CC2 271570a_100011220607_100000690907 [1,0,0,1,0,0|1,0,1]=4 1878 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [1,0,0,1,0,0|2,0,0]=4 1879 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [1,0,0,1,0,0|2,0,0]=4 1880 B14R2.601 C=C(C)c1ccc2[nH]c(=O)oc2c1 271570a_100000694244_100000697996 [0,0,0,1,0,1|1,0,1]=4 1881 B14R2.601 CC(=O)c1ccc2[nH]c(=O)oc2c1 1458a_100000744649_200000210301 [0,0,0,1,0,1|2,0,0]=4 1882 B14R2.601 CC(=O)c1ccc2c(c1)CC(O2)C 1458a_100000189409_200000210301 [0,0,0,1,0,1|2,0,0]=4 1883 B14R2.601 CC(=O)c1ccc2cn(nc2c1)C 1458a_100009851285_200000210301 [0,0,0,1,0,1|2,0,0]=4 1884 B14R2.601 CC1Cc2cc(ccc2O1)C(=O)[13CH3] 1458a_100000189409_200025704644 [0,0,0,1,0,1|2,0,0]=4 1885 B14R2.601 CN(C)c1ccc2nc(sc2c1)Cl 27a_100102631434_100010163703 [0,0,0,1,0,1|1,1,0]=4 1886 B14R2.601 CN1Cc2ccc(cc2C1)[N+](=O)[O-] 2230a_100000763510_200000210301 [0,0,0,1,0,1|1,0,1]=4 1887 B14R2.601 CN1Cc2ccc(cc2C1)[N+](=O)[O-] 269982a_100000763510_200000210301 [0,0,0,1,0,1|1,0,1]=4 1888 B14R2.601 Cn1cc2ccc(cc2n1)C(=O)[13CH3] 1458a_100009851285_200025704644 [0,0,0,1,0,1|2,0,0]=4 1889 B14R2.601 [13CH3]C(=O)c1ccc2[nH]c(=O)oc2c1 1458a_100000744649_200025704644 [0,0,0,1,0,1|2,0,0]=4 1890 B14R2.601 [13CH3]N1Cc2ccc(cc2C1)[N+](=O)[O-] 2230a_100000763510_200025704644 [0,0,0,1,0,1|1,0,1]=4 1891 B14R2.601 [13CH3]N1Cc2ccc(cc2C1)[N+](=O)[O-] 269982a_100000763510_200025704644 [0,0,0,1,0,1|1,0,1]=4 1892 B14R2.1006 CC(=O)Cc1ccc(cc1)C2CC2 271570a_100011220607_100000691760 [0,0,0,1,0,1|2,0,0]=4 1893 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 11a_100016991203_100015343762 [0,0,0,1,0,1|2,0,0]=4 1894 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 1626a_100016991203_100015343762 [0,0,0,1,0,1|2,0,0]=4 1895 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 22a_100016991203_100000070787 [0,0,0,1,0,1|2,0,0]=4 1896 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 271570a_100011220607_100000155215 [0,0,0,1,0,1|2,0,0]=4 1897 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 527a_100016991203_100103153847 [0,0,0,1,0,1|2,0,0]=4 1898 B14R2.1006 CC(=O)Oc1ccc(cc1)C2CC2 271570a_100011220607_100000002173 [0,0,0,1,0,1|2,0,0]=4 1899 B14R2.1006 CC(=O)Sc1ccc(cc1)C2CC2 271570a_100011220607_200009995050 [0,0,0,1,0,1|2,0,0]=4 1900 B14R2.1006 NC(=O)Cc1ccc(cc1)C2CC2 271570a_100011220607_100000162331 [0,0,0,1,0,1|2,0,0]=4 1901 B14R2.1006 NC(=O)Nc1ccc(cc1)C2CC2 271570a_100011220607_100000198584 [0,0,0,1,0,1|2,0,0]=4 1902 B14R2.9474 CC(=O)c1ccc(cc1)OC2CC2 34a_100000185113_100000211595 [0,0,0,1,0,1|2,0,0]=4 1903 B14R2.9474 CC(=O)c1ccc(cc1)SC2CC2 62a_100000185465_100000211595 [0,0,0,1,0,1|2,0,0]=4 1904 B14R2.9474 NC(=O)c1ccc(cc1)NC2CC2 27a_100000212008_100000162191 [0,0,0,1,0,1|2,0,0]=4 1905 B14R2.9474 NC(=O)c1ccc(cc1)NC2CC2 34a_100000210537_100000211595 [0,0,0,1,0,1|2,0,0]=4 1906 B14R2.9474 NC(=O)c1ccc(cc1)OC2CC2 34a_100000746352_100000211595 [0,0,0,1,0,1|2,0,0]=4 1907 B14R2.9474 NC(=O)c1ccc(cc1)SC2CC2 62a_100000162191_100000211595 [0,0,0,1,0,1|2,0,0]=4 1908 B14R2.4348 CC(=O)c1ccc(c(c1)Br)C2CC2 271570a_100011220607_100010146554 [0,1,0,1,0,0|2,0,0]=4 1909 B14R2.4348 CC(=O)c1ccc(c(c1)C)C2CC2 271570a_100011220607_100000697869 [0,1,0,1,0,0|2,0,0]=4 1910 B14R2.4348 CC(=O)c1ccc(c(c1)F)C2CC2 271570a_100011220607_100000690002 [0,1,0,1,0,0|2,0,0]=4 1911 B14R2.4348 CC(=O)c1ccc(c(c1)N)C2CC2 271570a_100011220607_100009816534 [0,1,0,1,0,0|2,0,0]=4 1912 B14R2.4348 Cc1cc(ccc1C2CC2)C(=O)N 271570a_100011220607_100011218126 [0,1,0,1,0,0|2,0,0]=4 1913 B14R2.4348 NC(=O)c1ccc(c(c1)Br)C2CC2 271570a_100011220607_100009814583 [0,1,0,1,0,0|2,0,0]=4 1914 B14R2.4348 NC(=O)c1ccc(c(c1)F)C2CC2 271570a_100011220607_100000686215 [0,1,0,1,0,0|2,0,0]=4 1915 B14R2.4348 NC(=O)c1ccc(c(c1)O)C2CC2 271570a_100011220607_100012344895 [0,1,0,1,0,0|2,0,0]=4 1916 B14R2.4349 CC(=O)c1ccc(cc1C)C2CC2 1458a_100009915035_200000210301 [0,1,0,1,0,0|2,0,0]=4 1917 B14R2.4349 CC(=O)c1ccc(cc1C)C2CC2 271570a_100011220607_100012360112 [0,1,0,1,0,0|2,0,0]=4 1918 B14R2.4349 CC(=O)c1ccc(cc1F)C2CC2 1458a_100011688859_200000210301 [0,1,0,1,0,0|2,0,0]=4 1919 B14R2.4349 CC(=O)c1ccc(cc1F)C2CC2 271570a_100011220607_100000690205 [0,1,0,1,0,0|2,0,0]=4 1920 B14R2.4349 CC(=O)c1ccc(cc1N)C2CC2 271570a_100011220607_100011590516 [0,1,0,1,0,0|2,0,0]=4 1921 B14R2.4349 CC(=O)c1ccc(cc1O)C2CC2 271570a_100011220607_100000188348 [0,1,0,1,0,0|2,0,0]=4 1922 B14R2.4349 Cc1cc(ccc1C(=O)N)C2CC2 271570a_100011220607_100011327924 [0,1,0,1,0,0|2,0,0]=4 1923 B14R2.4349 Cc1cc(ccc1C(=O)[13CH3])C2CC2 1458a_100009915035_200025704644 [0,1,0,1,0,0|2,0,0]=4 1924 B14R2.4349 NC(=O)c1ccc(cc1Br)C2CC2 271570a_100011220607_200010146565 [0,1,0,1,0,0|2,0,0]=4 1925 B14R2.4349 NC(=O)c1ccc(cc1F)C2CC2 271570a_100011220607_100000216903 [0,1,0,1,0,0|2,0,0]=4 1926 B14R2.4349 NC(=O)c1ccc(cc1N)C2CC2 271570a_100011220607_100012349972 [0,1,0,1,0,0|2,0,0]=4 1927 B14R2.4349 NC(=O)c1ccc(cc1O)C2CC2 271570a_100011220607_100011550861 [0,1,0,1,0,0|2,0,0]=4 1928 B14R2.4349 [13CH3]C(=O)c1ccc(cc1F)C2CC2 1458a_100011688859_200025704644 [0,1,0,1,0,0|2,0,0]=4 1929 B14R2.5719 C=C(C)c1ccc2c(c1)CCN2C 271570a_100000694244_100009815432 [0,1,0,1,0,0|2,0,0]=4 1930 B14R2.5719 C=C(C)c1ccc2c(c1)COC2=O 271570a_100000694244_100009816608 [0,1,0,1,0,0|1,0,1]=4 1931 B14R2.5719 C=C(C)c1ccc2c(c1)OCC2=O 271570a_100000694244_100000686717 [0,1,0,1,0,0|1,0,1]=4 1932 B14R2.5719 CC(=O)c1ccc2c(c1)CCN2C 1458a_100000708782_200000210301 [0,1,0,1,0,0|1,0,0]=3 1933 B14R2.5719 CC(=O)c1ccc2c(c1)COC2=O 1458a_100000049098_200000210301 [0,1,0,1,0,0|2,0,0]=4 1934 B14R2.5719 CC(=O)c1ccc2c(c1)ccn2C 1458a_100011912520_200000210301 [0,1,0,1,0,0|1,0,1]=4 1935 B14R2.5719 CC(=O)c1ccc2c(c1)cnn2C 1458a_100009866526_200000210301 [0,1,0,1,0,0|1,0,1]=4 1936 B14R2.5719 CC(=O)c1ccc2c(c1)ncn2C 1458a_100000733711_200000210301 [0,1,0,1,0,0|1,0,1]=4 1937 B14R2.5719 CC(=O)c1ccc2c(c1)nnn2C 1458a_100011218984_200000210301 [0,1,0,1,0,0|2,0,0]=4 1938 B14R2.5719 CN(C)c1ccc2c(n1)CNC2=O 27a_100102631434_200009864240 [0,1,0,1,0,0|2,0,0]=4 1939 B14R2.5719 CN1CCc2c1ccc(c2)C(=O)[13CH3] 1458a_100000708782_200025704644 [0,1,0,1,0,0|1,0,0]=3 1940 B14R2.5719 Cn1ccc2c1ccc(c2)C(=O)[13CH3] 1458a_100011912520_200025704644 [0,1,0,1,0,0|1,0,1]=4 1941 B14R2.5719 Cn1cnc2c1ccc(c2)C(=O)[13CH3] 1458a_100000733711_200025704644 [0,1,0,1,0,0|1,0,1]=4 1942 B14R2.5719 Cn1ncc2c1ccc(c2)C(=O)[13CH3] 1458a_100009866526_200025704644 [0,1,0,1,0,0|1,0,1]=4 1943 B14R2.5719 Cn1nnc2c1ccc(c2)C(=O)[13CH3] 1458a_100011218984_200025704644 [0,1,0,1,0,0|2,0,0]=4 1944 B14R2.5719 [13CH3]C(=O)c1ccc2c(c1)COC2=O 1458a_100000049098_200025704644 [0,1,0,1,0,0|2,0,0]=4 1945 B14R2.964 CCC(=O)c1ccc(cc1)C2CC2 1458a_100011688853_100000210202 [0,1,0,1,0,0|2,0,0]=4 1946 B14R2.964 CCC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000211647 [0,1,0,1,0,0|2,0,0]=4 1947 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 11a_106832991635_100011688853 [0,1,0,1,0,0|2,0,0]=4 1948 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 1626a_100102657272_100011688853 [0,1,0,1,0,0|2,0,0]=4 1949 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 240690a_100102657272_100011688853 [0,1,0,1,0,0|2,0,0]=4 1950 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000155074 [0,1,0,1,0,0|2,0,0]=4 1951 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 527a_100102657272_100011688853 [0,1,0,1,0,0|2,0,0]=4 1952 B14R2.964 COC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000150774 [0,1,0,1,0,0|1,0,0]=3 1953 B14R2.964 COC(=O)c1ccc(cn1)C2CC2 271570a_100011220607_100000690920 [0,1,0,1,0,0|2,0,0]=4 1954 B14R2.964 COC(=O)c1ccc(nc1)C2CC2 271570a_100011220607_100000733799 [0,1,0,1,0,0|2,0,0]=4 1955 B14R2.964 N#CC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100009994572 [0,1,0,1,0,0|2,0,0]=4 1956 B14R2.964 NCC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000017248 [0,1,0,1,0,0|2,0,0]=4 1957 B14R2.964 NNC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000183614 [0,1,0,1,0,0|2,0,0]=4 1958 B14R2.964 O=C(CF)c1ccc(cc1)C2CC2 1458a_100011688853_100015361967 [0,1,0,1,0,0|2,0,0]=4 1959 B14R2.964 O=C(CO)c1ccc(cc1)C2CC2 271570a_100011220607_100011219529 [0,1,0,1,0,0|1,0,0]=3 1960 B14R2.964 O=CC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000725942 [0,1,0,1,0,0|1,0,1]=4 1961 B14R2.9475 CC(=O)c1ccc(cc1)N2CCC2 1458a_100012625857_200000210301 [0,1,0,1,0,0|1,0,0]=3 1962 B14R2.9475 CC(=O)c1ccc(nc1)N2CCC2 27a_100000754969_100000690552 [0,1,0,1,0,0|2,0,0]=4 1963 B14R2.9475 NC(=O)c1ccc(cc1)N2CCC2 27a_100000754969_100000162191 [0,1,0,1,0,0|1,0,0]=3 1964 B14R2.9475 NC(=O)c1ccc(nc1)N2CCC2 27a_100000754969_100000162237 [0,1,0,1,0,0|2,0,0]=4 1965 B14R2.9475 [13CH3]C(=O)c1ccc(cc1)N2CCC2 1458a_100012625857_200025704644 [0,1,0,1,0,0|1,0,0]=3 1966 B10R1.31 CN(C)c1ncc(s1)C=O 27a_100102631434_100009814069 [1,0,0,0,1,0|2,0,0]=4 1967 B12R1.4 C#Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000140223 [1,0,0,0,0,1|1,0,1]=4 1968 B12R1.4 C#Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000140223 [1,0,0,0,0,1|1,0,1]=4 1969 B12R1.4 C#Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361452 [1,0,0,0,0,1|1,0,1]=4 1970 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [1,0,0,0,0,1|2,0,0]=4 1971 B12R1.4 C=Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000034074 [1,0,0,0,0,1|1,0,0]=3 1972 B12R1.4 C=Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000034074 [1,0,0,0,0,1|1,0,0]=3 1973 B12R1.4 C=Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361436 [1,0,0,0,0,1|1,0,0]=3 1974 B12R1.4 C=Cc1ccc(cc1)CN(C)C 271570a_100011290941_100000174694 [1,0,0,0,0,1|1,0,0]=3 1975 B12R1.4 C=Cc1ccc(cc1)NC(C)C 271570a_100011290941_100000219625 [1,0,0,0,0,1|2,0,0]=4 1976 B12R1.4 C=Cc1ccc(cc1)NC(C)C 34a_100011218248_100000210206 [1,0,0,0,0,1|2,0,0]=4 1977 B12R1.4 C=Cc1ccc(cc1)OC(C)C 271570a_100011290941_100000169947 [1,0,0,0,0,1|2,0,0]=4 1978 B12R1.4 C=Cc1ccc(cc1)OC(C)C 34a_100000189437_100000210206 [1,0,0,0,0,1|2,0,0]=4 1979 B12R1.4 C=Cc1ccc(cc1)OC(C)C 7a_100000189437_100000210206 [1,0,0,0,0,1|2,0,0]=4 1980 B12R1.4 C=Cc1ccc(cc1)SC(C)C 271570a_100011290941_100009811894 [1,0,0,0,0,1|2,0,0]=4 1981 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000210206_100000748128 [1,0,0,0,0,1|2,0,0]=4 1982 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000748128_100000210206 [1,0,0,0,0,1|2,0,0]=4 1983 B12R1.4 C=Cc1ccc(cn1)CN(C)C 271570a_100011290941_106446545466 [1,0,0,0,0,1|2,0,0]=4 1984 B12R1.4 CC(=Cc1ccc(cc1)C=O)C 271570a_100102525489_100000186029 [1,0,0,0,0,1|1,0,0]=3 1985 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [1,0,0,0,0,1|1,0,1]=4 1986 B12R1.4 CC(=Cc1ccc(cn1)C=O)C 271570a_100102525489_100000766901 [1,0,0,0,0,1|2,0,0]=4 1987 B12R1.4 CC(=Cc1ccc(nc1)C=O)C 271570a_100102525489_100000754260 [1,0,0,0,0,1|2,0,0]=4 1988 B12R1.4 CC(=O)Cc1ccc(cc1)C=O 1458a_100000070787_100000075337 [1,0,0,0,0,1|2,0,0]=4 1989 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [1,0,0,0,0,1|2,0,0]=4 1990 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [1,0,0,0,0,1|2,0,0]=4 1991 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000691760_200025704644 [1,0,0,0,0,1|2,0,0]=4 1992 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000691760 [1,0,0,0,0,1|2,0,0]=4 1993 B12R1.4 CC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000184111_200025704644 [1,0,0,0,0,1|1,0,0]=3 1994 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [1,0,0,0,0,1|2,0,0]=4 1995 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [1,0,0,0,0,1|2,0,0]=4 1996 B12R1.4 CC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000155215 [1,0,0,0,0,1|2,0,0]=4 1997 B12R1.4 CC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000002173 [1,0,0,0,0,1|2,0,0]=4 1998 B12R1.4 CC(=O)Sc1ccc(cc1)S[13CH3] 62a_200009995050_200025704644 [1,0,0,0,0,1|2,0,0]=4 1999 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [1,0,0,0,0,1|1,0,1]=4 2000 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [1,0,0,0,0,1|1,0,1]=4 2001 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [1,0,0,0,0,1|1,0,1]=4 2002 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000188517_100000210206 [1,0,0,0,0,1|1,0,0]=3 2003 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000210206_100000188517 [1,0,0,0,0,1|1,0,0]=3 2004 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [1,0,0,0,0,1|1,0,1]=4 2005 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [1,0,0,0,0,1|1,0,1]=4 2006 B12R1.4 CC(C)Sc1ccc(cn1)C=O 62a_100000210206_100000766901 [1,0,0,0,0,1|2,0,0]=4 2007 B12R1.4 CC(C)Sc1ccc(cn1)C=O 62a_100000766901_100000210206 [1,0,0,0,0,1|2,0,0]=4 2008 B12R1.4 CC(C)Sc1ccc(nc1)C=O 62a_100000210206_100000754260 [1,0,0,0,0,1|2,0,0]=4 2009 B12R1.4 CC(C)Sc1ccc(nc1)C=O 62a_100000754260_100000210206 [1,0,0,0,0,1|2,0,0]=4 2010 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_100000070787_100000747183 [1,0,0,0,0,1|2,0,0]=4 2011 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_200000759805_200000210301 [1,0,0,0,0,1|2,0,0]=4 2012 B12R1.4 CCc1ccc(cc1)CC(=O)[13CH3] 1458a_200000759805_200025704644 [1,0,0,0,0,1|2,0,0]=4 2013 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100000683253_200000210301 [1,0,0,0,0,1|1,0,1]=4 2014 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100102631434_100000747183 [1,0,0,0,0,1|1,0,1]=4 2015 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100000683253_200000210301 [1,0,0,0,0,1|1,0,1]=4 2016 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100102631434_100000747183 [1,0,0,0,0,1|1,0,1]=4 2017 B12R1.4 CCc1ccc(cc1)CN(C)C 270004a_100102631434_100000211036 [1,0,0,0,0,1|1,0,1]=4 2018 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 2230a_100000683253_200025704644 [1,0,0,0,0,1|1,0,1]=4 2019 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 269982a_100000683253_200025704644 [1,0,0,0,0,1|1,0,1]=4 2020 B12R1.4 CCc1ccc(cc1)NC(=O)C 11a_100000211069_100015343762 [1,0,0,0,0,1|2,0,0]=4 2021 B12R1.4 CCc1ccc(cc1)NC(=O)C 1626a_100000211069_100015343762 [1,0,0,0,0,1|2,0,0]=4 2022 B12R1.4 CCc1ccc(cc1)NC(=O)C 22a_100000211069_100000070787 [1,0,0,0,0,1|2,0,0]=4 2023 B12R1.4 CCc1ccc(cc1)NC(=O)C 527a_100000211069_100103153847 [1,0,0,0,0,1|2,0,0]=4 2024 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100000217971_200000210301 [1,0,0,0,0,1|1,0,1]=4 2025 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100102631434_100000184898 [1,0,0,0,0,1|1,0,1]=4 2026 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100000217971_200000210301 [1,0,0,0,0,1|1,0,1]=4 2027 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100102631434_100000184898 [1,0,0,0,0,1|1,0,1]=4 2028 B12R1.4 CN(C)Cc1ccc(cc1)C#N 270004a_100102631434_100000211122 [1,0,0,0,0,1|1,0,1]=4 2029 B12R1.4 CN(C)Cc1ccc(cc1)C#N 34a_100000217971_200000210301 [1,0,0,0,0,1|1,0,1]=4 2030 B12R1.4 CN(C)Cc1ccc(cc1)C=O 2230a_100102631434_100009816848 [1,0,0,0,0,1|0,0,0]=2 2031 B12R1.4 CN(C)Cc1ccc(cc1)C=O 269982a_100102631434_100009816848 [1,0,0,0,0,1|0,0,0]=2 2032 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [1,0,0,0,0,1|0,0,1]=3 2033 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [1,0,0,0,0,1|0,0,1]=3 2034 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [1,0,0,0,0,1|0,0,1]=3 2035 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_100000174694_200025704644 [1,0,0,0,0,1|2,0,0]=4 2036 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000174694 [1,0,0,0,0,1|2,0,0]=4 2037 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 2230a_100000217971_200025704644 [1,0,0,0,0,1|1,0,1]=4 2038 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 269982a_100000217971_200025704644 [1,0,0,0,0,1|1,0,1]=4 2039 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 34a_100000217971_200025704644 [1,0,0,0,0,1|1,0,1]=4 2040 B12R1.4 CNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219623 [1,0,0,0,0,1|2,0,0]=4 2041 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [1,0,0,0,0,1|1,0,0]=3 2042 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [1,0,0,0,0,1|1,0,0]=3 2043 B12R1.4 CNc1ccc(cc1)NC(=O)C 34a_100000184111_200000210301 [1,0,0,0,0,1|1,0,0]=3 2044 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [1,0,0,0,0,1|2,0,0]=4 2045 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [1,0,0,0,0,1|2,0,0]=4 2046 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [1,0,0,0,0,1|2,0,0]=4 2047 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [1,0,0,0,0,1|2,0,0]=4 2048 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [1,0,0,0,0,1|2,0,0]=4 2049 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [1,0,0,0,0,1|2,0,0]=4 2050 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [1,0,0,0,0,1|2,0,0]=4 2051 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [1,0,0,0,0,1|2,0,0]=4 2052 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [1,0,0,0,0,1|2,0,0]=4 2053 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [1,0,0,0,0,1|2,0,0]=4 2054 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [1,0,0,0,0,1|2,0,0]=4 2055 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [1,0,0,0,0,1|2,0,0]=4 2056 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [1,0,0,0,0,1|2,0,0]=4 2057 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [1,0,0,0,0,1|2,0,0]=4 2058 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [1,0,0,0,0,1|2,0,0]=4 2059 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [1,0,0,0,0,1|2,0,0]=4 2060 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [1,0,0,0,0,1|2,0,0]=4 2061 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [1,0,0,0,0,1|2,0,0]=4 2062 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000070787_100000181263 [1,0,0,0,0,1|2,0,0]=4 2063 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000756958_200000210301 [1,0,0,0,0,1|2,0,0]=4 2064 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_100000691760_200000210301 [1,0,0,0,0,1|2,0,0]=4 2065 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_200000210301_100000691760 [1,0,0,0,0,1|2,0,0]=4 2066 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [1,0,0,0,0,1|2,0,0]=4 2067 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [1,0,0,0,0,1|2,0,0]=4 2068 B12R1.4 CSc1ccc(cc1)CC(=O)[13CH3] 1458a_100000756958_200025704644 [1,0,0,0,0,1|2,0,0]=4 2069 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_100102631434_100000181263 [1,0,0,0,0,1|2,0,0]=4 2070 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_102495365258_200000210301 [1,0,0,0,0,1|2,0,0]=4 2071 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_100102631434_100011934452 [1,0,0,0,0,1|2,0,0]=4 2072 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_102495365258_200000210301 [1,0,0,0,0,1|2,0,0]=4 2073 B12R1.4 CSc1ccc(cc1)CN(C)C 270004a_100102631434_100000211154 [1,0,0,0,0,1|2,0,0]=4 2074 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_100000174694_200000210301 [1,0,0,0,0,1|2,0,0]=4 2075 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_200000210301_100000174694 [1,0,0,0,0,1|2,0,0]=4 2076 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 2230a_102495365258_200025704644 [1,0,0,0,0,1|2,0,0]=4 2077 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 269982a_102495365258_200025704644 [1,0,0,0,0,1|2,0,0]=4 2078 B12R1.4 CSc1ccc(cc1)NC(=O)C 11a_100000212337_100015343762 [1,0,0,0,0,1|2,0,0]=4 2079 B12R1.4 CSc1ccc(cc1)NC(=O)C 22a_100000212337_100000070787 [1,0,0,0,0,1|2,0,0]=4 2080 B12R1.4 CSc1ccc(cc1)NC(=O)C 527a_100000212337_100103153847 [1,0,0,0,0,1|2,0,0]=4 2081 B12R1.4 CSc1ccc(cc1)NC(=O)C 62a_200000210301_100000155215 [1,0,0,0,0,1|2,0,0]=4 2082 B12R1.4 CSc1ccc(cc1)NC(=O)N 62a_200000210301_100000198584 [1,0,0,0,0,1|2,0,0]=4 2083 B12R1.4 CSc1ccc(cc1)OC(=O)C 62a_200000210301_100000002173 [1,0,0,0,0,1|2,0,0]=4 2084 B12R1.4 CSc1ccc(cc1)SC(=O)C 62a_200009995050_200000210301 [1,0,0,0,0,1|2,0,0]=4 2085 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [1,0,0,0,0,1|1,0,0]=3 2086 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [1,0,0,0,0,1|1,0,0]=3 2087 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [1,0,0,0,0,1|2,0,0]=4 2088 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [1,0,0,0,0,1|2,0,0]=4 2089 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [1,0,0,0,0,1|2,0,0]=4 2090 B12R1.4 [13CH3]Sc1ccc(cc1)NC(=O)N 62a_200025704644_100000198584 [1,0,0,0,0,1|2,0,0]=4 2091 B12R1.258 C=C(C)c1cc(ccn1)N(C)C 271570a_100000694244_100000766659 [0,0,0,0,1,1|2,0,0]=4 2092 B12R1.258 C=C(C)c1cccc(c1)N(C)C 271570a_100000694244_100011215952 [0,0,0,0,1,1|2,0,0]=4 2093 B12R1.258 C=C(C)c1ccnc(c1)N(C)C 271570a_100000694244_100012361627 [0,0,0,0,1,1|2,0,0]=4 2094 B12R1.258 C=C(C)c1cncc(c1)N(C)C 271570a_100000694244_100012350714 [0,0,0,0,1,1|2,0,0]=4 2095 B12R1.258 CC(=O)c1cccc(c1)C(C)C 1458a_100011934808_200000210301 [0,0,0,0,1,1|2,0,0]=4 2096 B12R1.258 CC(=O)c1cccc(c1)N(C)C 1458a_100000210872_200000210301 [0,0,0,0,1,1|1,0,0]=3 2097 B12R1.258 CC(=O)c1cccc(n1)N(C)C 27a_100102631434_100000085735 [0,0,0,0,1,1|2,0,0]=4 2098 B12R1.258 CC(=O)c1ccnc(n1)N(C)C 27a_100102631434_100010643186 [0,0,0,0,1,1|2,0,0]=4 2099 B12R1.258 CC(C)c1cccc(c1)C(=O)[13CH3] 1458a_100011934808_200025704644 [0,0,0,0,1,1|2,0,0]=4 2100 B12R1.258 CC(O)c1cc(ccn1)N(C)C 27a_100102631434_100000144657 [0,0,0,0,1,1|1,0,1]=4 2101 B12R1.258 CN(C)c1cc(cnn1)C(=O)N 27a_100102631434_100015785749 [0,0,0,0,1,1|2,0,0]=4 2102 B12R1.258 CN(C)c1cc(ncn1)C(=O)N 27a_100102631434_100000725265 [0,0,0,0,1,1|2,0,0]=4 2103 B12R1.258 CN(C)c1cccc(c1)C(=O)[13CH3] 1458a_100000210872_200025704644 [0,0,0,0,1,1|1,0,0]=3 2104 B12R1.258 CN(C)c1cccc(c1)[N+](=O)[O-] 269982a_102515432896_200000210301 [0,0,0,0,1,1|1,0,1]=4 2105 B12R1.258 CN(C)c1cccc(c1)[N+](=O)[O-] 34a_102515432896_200000210301 [0,0,0,0,1,1|1,0,1]=4 2106 B12R1.258 CN(C)c1cccc(n1)C(=O)N 27a_100102631434_100011834053 [0,0,0,0,1,1|2,0,0]=4 2107 B12R1.258 CN(C)c1ccnc(c1)C(=O)N 27a_100102631434_100000229564 [0,0,0,0,1,1|1,0,0]=3 2108 B12R1.258 CN(C)c1cncc(n1)C(=O)N 27a_100102631434_100000764846 [0,0,0,0,1,1|2,0,0]=4 2109 B12R1.258 CN(C)c1nccc(n1)C(=O)N 27a_100102631434_100000066158 [0,0,0,0,1,1|2,0,0]=4 2110 B12R1.258 CN([13CH3])c1cccc(c1)[N+](=O)[O-] 269982a_102515432896_200025704644 [0,0,0,0,1,1|1,0,1]=4 2111 B12R1.258 CN([13CH3])c1cccc(c1)[N+](=O)[O-] 34a_102515432896_200025704644 [0,0,0,0,1,1|1,0,1]=4 2112 B14R1.419 C=C(C)CNc1ccc(cc1)N(C)C 34a_100016997997_100000748629 [0,0,0,0,0,2|2,0,0]=4 2113 B14R1.419 C=C(C)COc1ccc(cc1)N(C)C 34a_100000718910_100000748629 [0,0,0,0,0,2|2,0,0]=4 2114 B14R1.419 C=C(C)CSc1ccc(cc1)N(C)C 62a_100000210421_100000211660 [0,0,0,0,0,2|2,0,0]=4 2115 B14R1.419 C=C(C)CSc1ccc(cc1)N(C)C 62a_100000748629_100000210421 [0,0,0,0,0,2|2,0,0]=4 2116 B14R1.419 C=C(F)CNc1ccc(cc1)N(C)C 34a_100016997997_100009893438 [0,0,0,0,0,2|2,0,0]=4 2117 B14R1.419 C=C(F)COc1ccc(cc1)N(C)C 34a_100000718910_100009893438 [0,0,0,0,0,2|2,0,0]=4 2118 B14R1.419 C=C(F)CSc1ccc(cc1)N(C)C 62a_100000042424_100000210421 [0,0,0,0,0,2|2,0,0]=4 2119 B14R1.419 C=C(F)CSc1ccc(cc1)N(C)C 62a_100000210421_100000042424 [0,0,0,0,0,2|2,0,0]=4 2120 B14R1.419 CC(=O)C=Cc1ccc(cc1)C(C)C 1458a_100000185018_200000210301 [0,0,0,0,0,2|2,0,0]=4 2121 B14R1.419 CC(=O)C=Cc1ccc(cc1)N(C)C 1458a_100016270256_200000210301 [0,0,0,0,0,2|1,0,0]=3 2122 B14R1.419 CC(=O)CCc1ccc(cc1)C(C)C 1458a_100000234928_200000210301 [0,0,0,0,0,2|2,0,0]=4 2123 B14R1.419 CC(=O)CCc1ccc(cc1)N(C)C 1458a_100000205957_200000210301 [0,0,0,0,0,2|1,0,0]=3 2124 B14R1.419 CC(=O)COc1ccc(cc1)C(C)C 1458a_100000189144_200000210301 [0,0,0,0,0,2|2,0,0]=4 2125 B14R1.419 CC(=O)CSc1ccc(cc1)C(C)C 1458a_100000740577_200000210301 [0,0,0,0,0,2|2,0,0]=4 2126 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 11a_100000174979_100015343762 [0,0,0,0,0,2|2,0,0]=4 2127 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 1626a_100000174979_100015343762 [0,0,0,0,0,2|2,0,0]=4 2128 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 240690a_100000174979_100015343762 [0,0,0,0,0,2|2,0,0]=4 2129 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 527a_100000174979_100103153847 [0,0,0,0,0,2|2,0,0]=4 2130 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 11a_100000199032_100015343762 [0,0,0,0,0,2|1,0,0]=3 2131 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 1626a_100000199032_100015343762 [0,0,0,0,0,2|1,0,0]=3 2132 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 240690a_100000199032_100015343762 [0,0,0,0,0,2|1,0,0]=3 2133 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 527a_100000199032_100103153847 [0,0,0,0,0,2|1,0,0]=3 2134 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 11a_100000738136_100015343762 [0,0,0,0,0,2|2,0,0]=4 2135 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 1626a_100000738136_100015343762 [0,0,0,0,0,2|2,0,0]=4 2136 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 240690a_100000738136_100015343762 [0,0,0,0,0,2|2,0,0]=4 2137 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 527a_100000738136_100103153847 [0,0,0,0,0,2|2,0,0]=4 2138 B14R1.419 CC(=O)NNc1ccc(cc1)C(C)C 22a_100000005945_100000070787 [0,0,0,0,0,2|2,0,0]=4 2139 B14R1.419 CC(=O)NNc1ccc(cc1)N(C)C 22a_100134618393_100000070787 [0,0,0,0,0,2|1,0,0]=3 2140 B14R1.419 CC(=O)c1ccc(cc1)C=CC(C)C 271570a_100016257149_100000185465 [0,0,0,0,0,2|2,0,0]=4 2141 B14R1.419 CC(=O)c1ccc(cc1)CCN(C)C 2230a_100102631434_200000038727 [0,0,0,0,0,2|1,0,0]=3 2142 B14R1.419 CC(=O)c1ccc(cc1)CCN(C)C 269982a_100102631434_200000038727 [0,0,0,0,0,2|1,0,0]=3 2143 B14R1.419 CC(=O)c1ccc(cc1)CNC(C)C 2230a_100138425928_100000756337 [0,0,0,0,0,2|2,0,0]=4 2144 B14R1.419 CC(=O)c1ccc(cc1)CNC(C)C 34a_100138425928_100000756337 [0,0,0,0,0,2|2,0,0]=4 2145 B14R1.419 CC(=O)c1ccc(cc1)COC(C)C 34a_100000212225_100000756337 [0,0,0,0,0,2|2,0,0]=4 2146 B14R1.419 CC(=O)c1ccc(cc1)COC(C)C 7a_100000082505_100000210206 [0,0,0,0,0,2|2,0,0]=4 2147 B14R1.419 CC(=O)c1ccc(cc1)CSC(C)C 62a_100000210206_100000756337 [0,0,0,0,0,2|2,0,0]=4 2148 B14R1.419 CC(=O)c1ccc(cc1)CSC(C)C 62a_100000756337_100000210206 [0,0,0,0,0,2|2,0,0]=4 2149 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 1458a_100000182900_200000210301 [0,0,0,0,0,2|2,0,0]=4 2150 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 34a_100000185113_100000210624 [0,0,0,0,0,2|2,0,0]=4 2151 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 7a_100000185113_100000210760 [0,0,0,0,0,2|2,0,0]=4 2152 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)C 62a_100000185465_100000210760 [0,0,0,0,0,2|2,0,0]=4 2153 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)C 62a_100000210624_100000185465 [0,0,0,0,0,2|2,0,0]=4 2154 B14R1.419 CC(C)C=Cc1ccc(cc1)C(=O)N 271570a_100016257149_100000162191 [0,0,0,0,0,2|2,0,0]=4 2155 B14R1.419 CC(C)CNc1ccc(cc1)C(=O)N 27a_100000210953_100000162191 [0,0,0,0,0,2|2,0,0]=4 2156 B14R1.419 CC(C)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000210624 [0,0,0,0,0,2|2,0,0]=4 2157 B14R1.419 CC(C)COc1ccc(cc1)C(=O)N 34a_100000746352_100000210624 [0,0,0,0,0,2|2,0,0]=4 2158 B14R1.419 CC(C)COc1ccc(cc1)C(=O)N 7a_100000746352_100000210760 [0,0,0,0,0,2|2,0,0]=4 2159 B14R1.419 CC(C)COc1ccc(cc1)C(=O)[13CH3] 1458a_100000182900_200025704644 [0,0,0,0,0,2|2,0,0]=4 2160 B14R1.419 CC(C)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000210760 [0,0,0,0,0,2|2,0,0]=4 2161 B14R1.419 CC(C)CSc1ccc(cc1)C(=O)N 62a_100000210624_100000162191 [0,0,0,0,0,2|2,0,0]=4 2162 B14R1.419 CC(C)NCc1ccc(cc1)C(=O)N 207a_100138425928_100000038677 [0,0,0,0,0,2|2,0,0]=4 2163 B14R1.419 CC(C)NCc1ccc(cc1)C(=O)N 2230a_100138425928_100000231043 [0,0,0,0,0,2|2,0,0]=4 2164 B14R1.419 CC(C)NCc1ccc(cc1)C(=O)N 34a_100138425928_100000231043 [0,0,0,0,0,2|2,0,0]=4 2165 B14R1.419 CC(C)NCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210206 [0,0,0,0,0,2|1,0,0]=3 2166 B14R1.419 CC(C)NCc1ccc(nc1)C(=O)O 269956a_100000762669_100000210206 [0,0,0,0,0,2|2,0,0]=4 2167 B14R1.419 CC(C)OCc1ccc(cc1)C(=O)N 34a_100000162016_100000210206 [0,0,0,0,0,2|2,0,0]=4 2168 B14R1.419 CC(C)OCc1ccc(cc1)C(=O)N 34a_100000212225_100000231043 [0,0,0,0,0,2|2,0,0]=4 2169 B14R1.419 CC(C)OCc1ccc(cc1)C(=O)N 7a_100000162016_100000210206 [0,0,0,0,0,2|2,0,0]=4 2170 B14R1.419 CC(C)SCc1ccc(cc1)C(=O)N 62a_100000210206_100000231043 [0,0,0,0,0,2|2,0,0]=4 2171 B14R1.419 CC(C)SCc1ccc(cc1)C(=O)N 62a_100000231043_100000210206 [0,0,0,0,0,2|2,0,0]=4 2172 B14R1.419 CC(C)c1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000185018_200025704644 [0,0,0,0,0,2|2,0,0]=4 2173 B14R1.419 CC(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234928_200025704644 [0,0,0,0,0,2|2,0,0]=4 2174 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 2230a_100000210773_100000747473 [0,0,0,0,0,2|2,0,0]=4 2175 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 34a_100000210773_100000187820 [0,0,0,0,0,2|2,0,0]=4 2176 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 7a_100000210773_100000187820 [0,0,0,0,0,2|2,0,0]=4 2177 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)[O-] 34a_100000210773_100020667443 [0,0,0,0,0,2|1,0,1]=4 2178 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)N 34a_100000181308_100000187820 [0,0,0,0,0,2|2,0,0]=4 2179 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)N 7a_100000181308_100000187820 [0,0,0,0,0,2|2,0,0]=4 2180 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)[13CH3] 1458a_100000189144_200025704644 [0,0,0,0,0,2|2,0,0]=4 2181 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)[O-] 34a_100000181308_100020667443 [0,0,0,0,0,2|1,0,1]=4 2182 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000750031 [0,0,0,0,0,2|2,0,0]=4 2183 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)N 62a_100000750031_100000747473 [0,0,0,0,0,2|2,0,0]=4 2184 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[13CH3] 1458a_100000740577_200025704644 [0,0,0,0,0,2|2,0,0]=4 2185 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000750031_100020667443 [0,0,0,0,0,2|1,0,1]=4 2186 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000750031 [0,0,0,0,0,2|1,0,1]=4 2187 B14R1.419 CC(O)C=Cc1ccc(cc1)N(C)C 271570a_200011019289_100000210421 [0,0,0,0,0,2|1,0,1]=4 2188 B14R1.419 CC(O)CNc1ccc(cc1)N(C)C 34a_100016997997_100011218427 [0,0,0,0,0,2|1,0,1]=4 2189 B14R1.419 CC(O)COc1ccc(cc1)N(C)C 34a_100000718910_100011218427 [0,0,0,0,0,2|1,0,1]=4 2190 B14R1.419 CC(O)CSc1ccc(cc1)N(C)C 62a_100000210421_100011218427 [0,0,0,0,0,2|1,0,1]=4 2191 B14R1.419 CC(O)CSc1ccc(cc1)N(C)C 62a_100011218427_100000210421 [0,0,0,0,0,2|1,0,1]=4 2192 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 2230a_100000009637_200000210301 [0,0,0,0,0,2|1,0,1]=4 2193 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 2230a_100102631434_100000736421 [0,0,0,0,0,2|1,0,1]=4 2194 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 269982a_100000009637_200000210301 [0,0,0,0,0,2|1,0,1]=4 2195 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 269982a_100102631434_100000736421 [0,0,0,0,0,2|1,0,1]=4 2196 B14R1.419 CN(C)c1ccc(cc1)C=CC(=O)[13CH3] 1458a_100016270256_200025704644 [0,0,0,0,0,2|1,0,0]=3 2197 B14R1.419 CN(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000205957_200025704644 [0,0,0,0,0,2|1,0,0]=3 2198 B14R1.419 CN(C)c1ccc(cc1)NCC(=O)N 34a_100016997997_100000187820 [0,0,0,0,0,2|1,0,0]=3 2199 B14R1.419 CN(C)c1ccc(cc1)NCC(=O)[O-] 34a_100016997997_100020667443 [0,0,0,0,0,2|0,0,1]=3 2200 B14R1.419 CN(C)c1ccc(cc1)NC[N+](=O)[O-] 34a_100016997997_100000761209 [0,0,0,0,0,2|1,0,1]=4 2201 B14R1.419 CN(C)c1ccc(cc1)OCC(=O)N 34a_100000718910_100000187820 [0,0,0,0,0,2|1,0,0]=3 2202 B14R1.419 CN(C)c1ccc(cc1)OCC(=O)[O-] 34a_100000718910_100020667443 [0,0,0,0,0,2|0,0,1]=3 2203 B14R1.419 CN(C)c1ccc(cc1)OC[N+](=O)[O-] 34a_100000718910_100000761209 [0,0,0,0,0,2|1,0,1]=4 2204 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)N 62a_100000210421_100000747473 [0,0,0,0,0,2|1,0,0]=3 2205 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000210421 [0,0,0,0,0,2|1,0,0]=3 2206 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000210421_100020667443 [0,0,0,0,0,2|0,0,1]=3 2207 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000210421 [0,0,0,0,0,2|0,0,1]=3 2208 B14R1.419 CN(C)c1ccc(cc1)SC[N+](=O)[O-] 62a_100000210421_100000761209 [0,0,0,0,0,2|1,0,1]=4 2209 B14R1.419 CN(C)c1ccc(cn1)SCC(=O)N 62a_100000747473_100011465347 [0,0,0,0,0,2|2,0,0]=4 2210 B14R1.419 CN(C)c1ccc(cn1)SCC(=O)N 62a_100011465347_100000747473 [0,0,0,0,0,2|2,0,0]=4 2211 B14R1.419 CN(C)c1ccc(cn1)SCC(=O)[O-] 62a_100011465347_100020667443 [0,0,0,0,0,2|1,0,1]=4 2212 B14R1.419 CN(C)c1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100011465347 [0,0,0,0,0,2|1,0,1]=4 2213 B14R1.419 CN(C)c1ccc(nc1)SCC(=O)N 62a_100000747473_100009992925 [0,0,0,0,0,2|2,0,0]=4 2214 B14R1.419 CN(C)c1ccc(nc1)SCC(=O)N 62a_100009992925_100000747473 [0,0,0,0,0,2|2,0,0]=4 2215 B14R1.419 CN(C)c1ccc(nc1)SCC(=O)[O-] 62a_100009992925_100020667443 [0,0,0,0,0,2|1,0,1]=4 2216 B14R1.419 CN(C)c1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100009992925 [0,0,0,0,0,2|1,0,1]=4 2217 B14R1.419 CN([13CH3])CCc1ccc(cc1)[N+](=O)[O-] 2230a_100000009637_200025704644 [0,0,0,0,0,2|1,0,1]=4 2218 B14R1.419 CN([13CH3])CCc1ccc(cc1)[N+](=O)[O-] 269982a_100000009637_200025704644 [0,0,0,0,0,2|1,0,1]=4 2219 B14R1.419 C[C@@H](O)CNc1ccc(cc1)N(C)C 34a_100016997997_100009817552 [0,0,0,0,0,2|1,0,1]=4 2220 B14R1.419 C[C@@H](O)COc1ccc(cc1)N(C)C 34a_100000718910_100009817552 [0,0,0,0,0,2|1,0,1]=4 2221 B14R1.419 C[C@@H](O)CSc1ccc(cc1)N(C)C 62a_100000210421_100009817552 [0,0,0,0,0,2|1,0,1]=4 2222 B14R1.419 C[C@@H](O)CSc1ccc(cc1)N(C)C 62a_100009817552_100000210421 [0,0,0,0,0,2|1,0,1]=4 2223 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)N 34a_100010188728_100000187820 [0,0,0,0,0,2|2,0,0]=4 2224 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)N 7a_100010188728_100000187820 [0,0,0,0,0,2|2,0,0]=4 2225 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)[O-] 34a_100010188728_100020667443 [0,0,0,0,0,2|1,0,1]=4 2226 B14R1.805 CC(=Cc1ccc(cc1)CC(=O)N)C 271570a_100102525489_100000162331 [0,0,0,0,0,2|2,0,0]=4 2227 B14R1.805 CC(=Cc1ccc(cc1)CN(C)C)C 271570a_100102525489_100000174694 [0,0,0,0,0,2|2,0,0]=4 2228 B14R1.805 CC(=Cc1ccc(cc1)NC(=O)N)C 271570a_100102525489_100000198584 [0,0,0,0,0,2|2,0,0]=4 2229 B14R1.805 CC(=O)Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100000691760 [0,0,0,0,0,2|2,0,0]=4 2230 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000070787_100011982790 [0,0,0,0,0,2|2,0,0]=4 2231 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000204619_200000210301 [0,0,0,0,0,2|2,0,0]=4 2232 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 1458a_100000244678_200000210301 [0,0,0,0,0,2|2,0,0]=4 2233 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 34a_100011218180_100000210206 [0,0,0,0,0,2|2,0,0]=4 2234 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 7a_100011218180_100000210206 [0,0,0,0,0,2|2,0,0]=4 2235 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000210206_100000691760 [0,0,0,0,0,2|2,0,0]=4 2236 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000691760_100000210206 [0,0,0,0,0,2|2,0,0]=4 2237 B14R1.805 CC(=O)Nc1ccc(cc1)C=C(C)C 271570a_100102525489_100000155215 [0,0,0,0,0,2|2,0,0]=4 2238 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 11a_100000687309_100015343762 [0,0,0,0,0,2|2,0,0]=4 2239 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 1626a_100000687309_100015343762 [0,0,0,0,0,2|2,0,0]=4 2240 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 22a_100000687309_100000070787 [0,0,0,0,0,2|2,0,0]=4 2241 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 527a_100000687309_100103153847 [0,0,0,0,0,2|2,0,0]=4 2242 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 11a_100000246131_100015343762 [0,0,0,0,0,2|1,0,0]=3 2243 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 2230a_100102631434_100000731167 [0,0,0,0,0,2|1,0,0]=3 2244 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 22a_100000246131_100000070787 [0,0,0,0,0,2|1,0,0]=3 2245 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 269982a_100102631434_100000731167 [0,0,0,0,0,2|1,0,0]=3 2246 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 527a_100000246131_100103153847 [0,0,0,0,0,2|1,0,0]=3 2247 B14R1.805 CC(=O)Nc1ccc(cc1)NC(C)C 34a_100000184111_100000210206 [0,0,0,0,0,2|2,0,0]=4 2248 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 11a_100011194259_100015343762 [0,0,0,0,0,2|2,0,0]=4 2249 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 1626a_100011194259_100015343762 [0,0,0,0,0,2|2,0,0]=4 2250 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 22a_100011194259_100000070787 [0,0,0,0,0,2|2,0,0]=4 2251 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 34a_100000184395_100000210206 [0,0,0,0,0,2|2,0,0]=4 2252 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 527a_100011194259_100103153847 [0,0,0,0,0,2|2,0,0]=4 2253 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 7a_100000184395_100000210206 [0,0,0,0,0,2|2,0,0]=4 2254 B14R1.805 CC(=O)Nc1ccc(cc1)SC(C)C 62a_100000210206_100000155215 [0,0,0,0,0,2|2,0,0]=4 2255 B14R1.805 CC(=O)Oc1ccc(cc1)C=C(C)C 271570a_100102525489_100000002173 [0,0,0,0,0,2|2,0,0]=4 2256 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 2230a_100102631434_100000033664 [0,0,0,0,0,2|1,0,0]=3 2257 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 269982a_100102631434_100000033664 [0,0,0,0,0,2|1,0,0]=3 2258 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 270004a_100102631434_100000014718 [0,0,0,0,0,2|1,0,0]=3 2259 B14R1.805 CC(=O)Oc1ccc(cc1)SC(C)C 62a_100000210206_100000002173 [0,0,0,0,0,2|2,0,0]=4 2260 B14R1.805 CC(=O)Sc1ccc(cc1)C=C(C)C 271570a_100102525489_200009995050 [0,0,0,0,0,2|2,0,0]=4 2261 B14R1.805 CC(=O)Sc1ccc(cc1)SC(C)C 62a_200009995050_100000210206 [0,0,0,0,0,2|2,0,0]=4 2262 B14R1.805 CC(C)Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000204619_200025704644 [0,0,0,0,0,2|2,0,0]=4 2263 B14R1.805 CC(C)Nc1ccc(cc1)CC(=O)N 2230a_100000738315_100000210206 [0,0,0,0,0,2|2,0,0]=4 2264 B14R1.805 CC(C)Nc1ccc(cc1)CC(=O)N 34a_100000738315_100000210206 [0,0,0,0,0,2|2,0,0]=4 2265 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)N 34a_100000020825_100000210206 [0,0,0,0,0,2|2,0,0]=4 2266 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)[13CH3] 1458a_100000244678_200025704644 [0,0,0,0,0,2|2,0,0]=4 2267 B14R1.805 CC(C)Sc1ccc(cc1)CC(=O)N 62a_100000162331_100000210206 [0,0,0,0,0,2|2,0,0]=4 2268 B14R1.805 CC(C)Sc1ccc(cc1)CC(=O)N 62a_100000210206_100000162331 [0,0,0,0,0,2|2,0,0]=4 2269 B14R1.805 CC(C)Sc1ccc(cc1)NC(=O)N 62a_100000210206_100000198584 [0,0,0,0,0,2|2,0,0]=4